Chembase list of 866358 unique molecular structures

2-chloro-N-(ethoxymethyl)-N-[2-(propan-2-yl)phenyl]acetamide

$$$$ Data

M. F.

C14H20ClNO2

Suppliers	Catalog Number
Enamine	EN300-35480

Database	Data ID
PubChem	28819354

M. W.

269.7671

CAS

Similarity

N/A

ID: 255952

4-(2,2,2-trifluoroethoxy)cyclohexan-1-amine

$$$$ Data

M. F.

C8H14F3NO

Suppliers	Catalog Number
Enamine	EN300-35483

Database	Data ID
PubChem	16228801

M. W.

197.1980696

CAS

Similarity

N/A

ID: 255953

1-methyl-4,5,6,7-tetrahydro-1H-indazol-4-amine

$$$$ Data

M. F.

C8H13N3

Suppliers	Catalog Number
Enamine	EN300-35488

Database	Data ID
PubChem	43243410

M. W.

151.20892

CAS

Similarity

N/A

ID: 255954

6-(4-chlorophenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-amine

$$$$ Data

M. F.

C10H7ClN4S

Suppliers	Catalog Number
Enamine	EN300-35511

Database	Data ID
PubChem	3406617

M. W.

250.70738

CAS

Similarity

N/A

ID: 255955

4-[(2,4-dimethylphenyl)sulfanyl]aniline

$$$$ Data

M. F.

C14H15NS

Suppliers	Catalog Number
Enamine	EN300-35513

Database	Data ID
PubChem	2442328

M. W.

229.3406

CAS

Similarity

N/A

ID: 255956

2-[(butan-2-yl)amino]-N-(2,3-dimethylphenyl)acetamide

$$$$ Data

M. F.

C14H22N2O

Suppliers	Catalog Number
Enamine	EN300-35517

Database	Data ID
PubChem	3693102

M. W.

234.33728

CAS

Similarity

N/A

ID: 255957

methyl 4-aminobutanoate

$$$$ Data

M. F.

C5H11NO2

Suppliers	Catalog Number
Enamine	EN300-35518

Database	Data ID
PubChem	18614

M. W.

117.14634

CAS

Similarity

N/A

ID: 255958

[(3,4-diethoxyphenyl)methyl][3-(dimethylamino)propyl]amine

$$$$ Data

M. F.

C16H28N2O2

Suppliers	Catalog Number
Enamine	EN300-35519

Database	Data ID
PubChem	2110935

M. W.

280.40572

CAS

Similarity

N/A

ID: 255959

2-chloro-N-[2,5-diethoxy-4-(morpholin-4-yl)phenyl]propanamide

$$$$ Data

M. F.

C17H25ClN2O4

Suppliers	Catalog Number
Enamine	EN300-35520

Database	Data ID
PubChem	3688633

M. W.

356.8444

CAS

Similarity

N/A

ID: 255960

N-[(3-methoxyphenyl)methyl]adamantan-1-amine

$$$$ Data

M. F.

C18H25NO

Suppliers	Catalog Number
ChemBridge	5529974
Enamine	EN300-35521

Database	Data ID
PubChem	2850248

M. W.

271.3972

CAS

416891-29-7

Similarity

N/A

ID: 255961

3-(benzylamino)-1λ⁶-thiolane-1,1-dione

$$$$ Data

M. F.

C11H15NO2S

Suppliers	Catalog Number
ChemBridge	5115420
Enamine	EN300-35522

Database	Data ID
PubChem	2896541

M. W.

225.3073

CAS

321580-44-3

Similarity

N/A

ID: 255962

2-[(butylamino)methyl]-3,4-dihydroquinazolin-4-one

$$$$ Data

M. F.

C13H17N3O

Suppliers	Catalog Number
Enamine	EN300-35523

Database	Data ID
PubChem	2090938

M. W.

231.29358

CAS

Similarity

N/A

ID: 255963

3-methyl-5-(piperazine-1-sulfonyl)thiophene-2,4-dicarboxylic acid

$$$$ Data

M. F.

C11H14N2O6S2

Suppliers	Catalog Number
Enamine	EN300-35524

Database	Data ID
PubChem	2513415

M. W.

334.36866

CAS

Similarity

N/A

ID: 255964

methyl 6-aminohexanoate

$$$$ Data

M. F.

C7H15NO2

Suppliers	Catalog Number
Enamine	EN300-35525

Database	Data ID
PubChem	1810164

M. W.

145.1995

CAS

Similarity

N/A

ID: 255965

(2-methoxyethyl)({[5-(thiophen-2-yl)-1,3,4-oxadiazol-2-yl]methyl})amine

$$$$ Data

M. F.

C10H13N3O2S

Suppliers	Catalog Number
Enamine	EN300-35526

Database	Data ID
PubChem	3752402

M. W.

239.29412

CAS

Similarity

N/A

ID: 255966

1-[amino(phenyl)methyl]naphthalen-2-ol

$$$$ Data

M. F.

C17H15NO

Suppliers	Catalog Number
Enamine	EN300-35527
A&J Pharmtech	AJA-O39981

Database	Data ID
PubChem	235836

M. W.

249.3071

CAS

219897-32-2

Similarity

N/A

ID: 255967

N-{[2-(prop-2-en-1-yloxy)phenyl]methyl}-2,3-dihydro-1,4-benzodioxin-6-amine

$$$$ Data

M. F.

C18H19NO3

Suppliers	Catalog Number
Enamine	EN300-35530

Database	Data ID
PubChem	4961674

M. W.

297.34836

CAS

Similarity

N/A

ID: 255968

3-[(thiophen-2-ylmethyl)amino]-1λ⁶-thiolane-1,1-dione

$$$$ Data

M. F.

C9H13NO2S2

Suppliers	Catalog Number
Enamine	EN300-35533

Database	Data ID
PubChem	4961865

M. W.

231.33502

CAS

Similarity

N/A

ID: 255969

3-phenylimidazo[1,5-a]pyrazin-1-ol

$$$$ Data

M. F.

C12H9N3O

Suppliers	Catalog Number
Enamine	EN300-35535

Database	Data ID
PubChem	2557571

M. W.

211.21936

CAS

Similarity

N/A

ID: 255970

methyl piperidine-2-carboxylate

$$$$ Data

M. F.

C7H13NO2

Suppliers	Catalog Number
Enamine	EN300-35540
Bide Pharmatech	BD20761

Database	Data ID
PubChem	3463753

M. W.

143.18362

CAS

41994-45-0

Similarity

N/A

ID: 255971

N-(2-methylpropyl)-5H,6H,7H,8H,9H-[1,2,4]triazolo[4,3-a]azepin-3-amine

$$$$ Data

M. F.

C11H20N4

Suppliers	Catalog Number
Enamine	EN300-35541

Database	Data ID
PubChem	7131155

M. W.

208.3033

CAS

Similarity

N/A

ID: 255972

3-oxo-3-(piperidin-1-yl)-2-[5-(trifluoromethyl)pyridin-2-yl]propanenitrile

$$$$ Data

M. F.

C14H14F3N3O

Suppliers	Catalog Number
Enamine	EN300-35543

Database	Data ID
PubChem	43810605

M. W.

297.2756696

CAS

Similarity

N/A

ID: 255973

1-(5-cyano-6-oxo-1,6-dihydropyridine-3-carbonyl)-1-methylurea

$$$$ Data

M. F.

C9H8N4O3

Suppliers	Catalog Number
Enamine	EN300-35544

Database	Data ID
PubChem	25312485

M. W.

220.18482

CAS

Similarity

N/A

ID: 255974

2-(4-methyl-1,3-thiazol-2-yl)-1-(piperazin-1-yl)ethan-1-one

$$$$ Data

M. F.

C10H15N3OS

Suppliers	Catalog Number
Enamine	EN300-35546

Database	Data ID
PubChem	7130769

M. W.

225.3106

CAS

Similarity

N/A

ID: 255975

N-(2H-1,3-benzodioxol-5-yl)piperidine-4-carboxamide

$$$$ Data

M. F.

C13H16N2O3

Suppliers	Catalog Number
Enamine	EN300-35547

Database	Data ID
PubChem	7130661

M. W.

248.27774

CAS

Similarity

N/A

ID: 255976

N-ethyl-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide

$$$$ Data

M. F.

C11H14N2O2

Suppliers	Catalog Number
Enamine	EN300-35549

Database	Data ID
PubChem	16226851

M. W.

206.24106

CAS

Similarity

N/A

ID: 255977

1-[4-(cyclopentylsulfanyl)phenyl]ethan-1-one

$$$$ Data

M. F.

C13H16OS

Suppliers	Catalog Number
Enamine	EN300-35551

Database	Data ID
PubChem	25312490

M. W.

220.33054

CAS

Similarity

N/A

ID: 255978

sodium 2-phenyl-4,5,6,7-tetrahydro-2H-indazole-3-carboxylate

$$$$ Data

M. F.

C14H13N2NaO2

Suppliers	Catalog Number
Enamine	EN300-35552

Database	Data ID
PubChem	42956124

M. W.

264.25499

CAS

Similarity

N/A

ID: 255979

5-bromo-1,3-benzoxazol-2-amine

$$$$ Data

M. F.

C7H5BrN2O

Suppliers	Catalog Number
Enamine	EN300-35553
Bide Pharmatech	BD103033
A&J Pharmtech	AJA-O12992 AJA-O11267

Database	Data ID
PubChem	46380

M. W.

213.0314

CAS

64037-07-6

Similarity

N/A

ID: 255980

1-(4-methylphenyl)-6-oxo-1,4,5,6-tetrahydro-1,2,4-triazine-3-carboxylic acid

$$$$ Data

M. F.

C11H11N3O3

Suppliers	Catalog Number
Enamine	EN300-35555

Database	Data ID
PubChem	25312499

M. W.

233.22334

CAS

Similarity

N/A

ID: 255981

N,N'-bis(pyridin-3-yl)butanediamide

$$$$ Data

M. F.

C14H14N4O2

Suppliers	Catalog Number
Enamine	EN300-35557

Database	Data ID
PubChem	897084

M. W.

270.28656

CAS

Similarity

N/A

ID: 255982

4-methyl-5-phenyl-1,3-thiazol-2-amine

$$$$ Data

M. F.

C10H10N2S

Suppliers	Catalog Number
Enamine	EN300-35558

Database	Data ID
PubChem	244067

M. W.

190.2648

CAS

28241-62-5

Similarity

N/A

ID: 255983

methyl 2-amino-2-cyclopropylpropanoate hydrochloride

$$$$ Data

M. F.

C7H14ClNO2

Suppliers	Catalog Number
Enamine	EN300-35561

Database	Data ID
PubChem	53534225

M. W.

179.64456

CAS

Similarity

N/A

ID: 255984

1-[5-(2-fluorophenyl)thiophen-2-yl]ethan-1-one

$$$$ Data

M. F.

C12H9FOS

Suppliers	Catalog Number
Enamine	EN300-35562

Database	Data ID
PubChem	20100254

M. W.

220.2626632

CAS

Similarity

N/A

ID: 255985

2-[5-amino-3-(3-methoxyphenyl)-1H-pyrazol-1-yl]ethan-1-ol

$$$$ Data

M. F.

C12H15N3O2

Suppliers	Catalog Number
Enamine	EN300-35564

Database	Data ID
PubChem	16228461

M. W.

233.2664

CAS

Similarity

N/A

ID: 255986

8-nitro-1H,2H,4H,4aH,5H,6H-morpholino[4,3-a]quinoline-5-carboxylic acid

$$$$ Data

M. F.

C13H14N2O5

Suppliers	Catalog Number
Enamine	EN300-35565

Database	Data ID
PubChem	43810606

M. W.

278.26066

CAS

Similarity

N/A

ID: 255987

2-[5-amino-3-(2-methylfuran-3-yl)-1H-pyrazol-1-yl]ethan-1-ol

$$$$ Data

M. F.

C10H13N3O2

Suppliers	Catalog Number
Enamine	EN300-35566

Database	Data ID
PubChem	16228567

M. W.

207.22912

CAS

Similarity

N/A

ID: 255988

tert-butyl 4-(1-aminocyclopentanecarbonyl)piperazine-1-carboxylate

$$$$ Data

M. F.

C15H27N3O3

Suppliers	Catalog Number
Enamine	EN300-35567

Database	Data ID
PubChem	25312519

M. W.

297.39318

CAS

Similarity

N/A

ID: 255989

(2Z)-3-cyclopentyl-4-methyl-N-phenyl-2,3-dihydro-1,3-thiazol-2-imine

$$$$ Data

M. F.

C15H18N2S

Suppliers	Catalog Number
Enamine	EN300-35568

Database	Data ID
PubChem	2392712

M. W.

258.38182

CAS

Similarity

N/A

ID: 255990

tert-butyl 4-(1-aminocyclohexanecarbonyl)piperazine-1-carboxylate

$$$$ Data

M. F.

C16H29N3O3

Suppliers	Catalog Number
Enamine	EN300-35569

Database	Data ID
PubChem	25312533

M. W.

311.41976

CAS

Similarity

N/A

ID: 255991

(2Z)-N-(4-chlorophenyl)-3-ethyl-4-methyl-2,3-dihydro-1,3-thiazol-2-imine

$$$$ Data

M. F.

C12H13ClN2S

Suppliers	Catalog Number
Enamine	EN300-35570

Database	Data ID
PubChem	2140684

M. W.

252.76302

CAS

Similarity

N/A

ID: 255992

1-nitro-4-(pentafluoroethoxy)benzene

$$$$ Data

M. F.

C8H4F5NO3

Suppliers	Catalog Number
Enamine	EN300-35571

Database	Data ID
PubChem	4668554

M. W.

257.114276

CAS

Similarity

N/A

ID: 255993

1,3-bis(3,5-dichlorophenyl)urea

$$$$ Data

M. F.

C13H8Cl4N2O

Suppliers	Catalog Number
Enamine	EN300-35574

Database	Data ID
PubChem	595311

M. W.

350.02742

CAS

Similarity

N/A

ID: 255994

2-fluoro-5-[(propan-2-yl)sulfamoyl]benzoic acid

$$$$ Data

M. F.

C10H12FNO4S

Suppliers	Catalog Number
Enamine	EN300-35576

Database	Data ID
PubChem	16768245

M. W.

261.2699832

CAS

Similarity

N/A

ID: 255995

4-fluoro-3-[(propan-2-yl)sulfamoyl]benzoic acid

$$$$ Data

M. F.

C10H12FNO4S

Suppliers	Catalog Number
Enamine	EN300-35577

Database	Data ID
PubChem	977984

M. W.

261.2699832

CAS

Similarity

N/A

ID: 255996

6-chloro-5-nitro-2,3-dihydro-1H-indol-2-one

$$$$ Data

M. F.

C8H5ClN2O3

Suppliers	Catalog Number
Enamine	EN300-35578

Database	Data ID
PubChem	18932798

M. W.

212.5899

CAS

Similarity

N/A

ID: 255997

2-chloro-4-phenylaniline hydrochloride

$$$$ Data

M. F.

C12H11Cl2N

Suppliers	Catalog Number
Enamine	EN300-35579

Database	Data ID
PubChem	42935479

M. W.

240.12844

CAS

Similarity

N/A

ID: 255998

4-(4-tert-butylphenyl)-2-chloroaniline hydrochloride

$$$$ Data

M. F.

C16H19Cl2N

Suppliers	Catalog Number
Enamine	EN300-35580

Database	Data ID
PubChem	42935478

M. W.

296.23476

CAS

Similarity

N/A

ID: 255999

2-(hydroxymethyl)-N,N-dimethyl-1H-1,3-benzodiazole-5-sulfonamide

$$$$ Data

M. F.

C10H13N3O3S

Suppliers	Catalog Number
Enamine	EN300-35583

Database	Data ID
PubChem	16770262

M. W.

255.29352

CAS

Similarity

N/A

ID: 256000

(5Z)-5-(hydroxyimino)-7,7-dimethyl-5,6,7,8-tetrahydroquinazolin-2-amine

$$$$ Data

M. F.

C10H14N4O

Suppliers	Catalog Number
Enamine	EN300-35584

Database	Data ID
PubChem	14469561

M. W.

206.24436

CAS

Similarity

N/A

Part I: Carbon
- I.1: Carbon-Carbon Bonds
- I.1.1 Alkanes
- Primary carbon
- Secondary carbon
- Tertiary carbon
- Quaternary carbon
- I.1.2 C-C double and Triple Bonds
- Alkene
- Alkyne
- Allene
- I.2: One Carbon-Hetero Bond
- I.2.1 Alkyl Halogenides
- Alkylchloride
- Alkylfluoride
- Alkylbromide
- Alkyliodide
- I.2.2 Alcohols and Ethers
- Alcohol
- Primary alcohol
- Secondary alcohol
- Tertiary alcohol
- Dialkylether
- Dialkylthioether
- Alkylarylether
- Diarylether
- Alkylarylthioether
- Diarylthioether
- Oxonium
- I.2.3 Amines
- Amine
- Primary aliphatic amine
- Secondary aliphatic amine
- Tertiary aliphatic amine
- Quaternary aliphatic ammonium
- Primary aromatic amine
- Secondary aromatic amine
- Tertiary aromatic amine
- Quaternary aromatic ammonium
- Secondary mixed amine
- Tertiary mixed amine
- Quaternary mixed ammonium
- Ammonium
- I.2.4 Others
- Alkylthiol
- Dialkylthioether
- Alkylarylthioether
- Disulfide
- 1,2-Aminoalcohol
- 1,2-Diol
- 1,1-Diol
- Hydroperoxide
- Peroxo
- Organolithium compounds
- Organomagnesium compounds
- Organometallic compounds
- I.3: Two Carbon-Hetero Bonds (Carbonyl and Derivatives)
- I.3.1 Double Bond to Hetero
- Aldehyde
- Ketone
- Thioaldehyde
- Thioketone
- Imine
- Immonium
- Oxime
- Oximether
- I.3.2. Two Single Bonds to Hetero
- Acetal
- Hemiacetal
- Aminal
- Hemiaminal
- Thioacetal
- Thiohemiacetal
- Halogen acetal like
- Acetal like
- Halogenmethylen ester and similar
- NOS methylen ester and similar
- Hetero methylen ester and similar
- Cyanhydrine
- I.3.3 Single Bond to Hetero, C=C Double Bond (Enols and Similar)
- Chloroalkene
- Fluoroalkene
- Bromoalkene
- Iodoalkene
- Enol
- Endiol
- Enolether
- Enolester
- Enamine
- Thioenol
- Thioenolether
- I.4: Three Carbon-Hetero Bonds (Carboxyl and Derivatives)
- Acylchloride
- Acylfluoride
- Acylbromide
- Acyliodide
- Acylhalide
- Carboxylic acid
- Carboxylic ester
- Lactone
- Carboxylic anhydride
- Carboxylic acid derivative
- Carbothioic acid
- Carbothioic S ester
- Carbothioic S lactone
- Carbothioic O ester
- Carbothioic O lactone
- Carbothioic halide
- Carbodithioic acid
- Carbodithioic ester
- Carbodithiolactone
- Amide
- Primary amide
- Secondary amide
- Tertiary amide
- Lactam
- Alkyl imide
- N hetero imide
- Imide acidic
- Thioamide
- Thiolactam
- Oximester
- Amidine
- Hydroxamic acid
- Hydroxamic acid ester
- Imidoacid
- Imidoacid cyclic
- Imidoester
- Imidolactone
- Imidothioacid
- Imidothioacid cyclic
- Imidothioester
- Imidothiolactone
- Amidine
- Imidolactam
- Imidoylhalide
- Imidoylhalide cyclic
- Amidrazone
- Alpha aminoacid
- Alpha hydroxyacid
- Peptide middle
- Peptide C term
- Peptide N term
- Carboxylic orthoester
- Ketene
- Ketenacetal
- Nitrile
- Isonitrile
- Vinylogous carbonyl or carboxyl derivative
- Vinylogous acid
- Vinylogous ester
- Vinylogous amide
- Vinylogous halide
- I.5: Four Carbon-Hetero Bonds (Carbonic Acid and Derivatives)
- Carbonic acid dieester
- Carbonic acid esterhalide
- Carbonic acid monoester
- Carbonic acid derivatives
- Thiocarbonic acid dieester
- Thiocarbonic acid esterhalide
- Thiocarbonic acid monoester
- Urea
- Thiourea
- Isourea
- Isothiourea
- Guanidine
- Carbaminic acid
- Urethan(Carbamate ester)
- Biuret
- Semicarbazide
- Carbazide
- Semicarbazone
- Carbazone
- Thiosemicarbazide
- Thiocarbazide
- Thiosemicarbazone
- Thiocarbazone
- Isocyanate
- Cyanate
- Isothiocyanate
- Thiocyanate
- Carbodiimide
- Orthocarbonic derivatives
- I.6 Aromatics
- Phenol
- 1,2-Diphenol
- Arylchloride
- Arylfluoride
- Arylbromide
- Aryliodide
- Arylthiol
- Iminoarene
- Oxoarene
- Thioarene
- Hetero N basic H
- Hetero N basic no H
- Hetero N nonbasic
- Hetero O
- Hetero S
- Heteroaromatic
Part II: N, S, P, Si, B
- II.1 Nitrogen
- Nitrite
- Thionitrite
- Nitrate
- Nitro
- Nitroso
- Azide
- Acylazide
- Diazo
- Diazonium
- Nitrosamine
- Nitrosamide
- N-Oxide
- Hydrazine
- Hydrazone
- Hydroxylamine
- II.2 Sulfur
- Sulfon
- Sulfoxide
- Sulfonium
- Sulfuric acid
- Sulfuric monoester
- Sulfuric diester
- Sulfuric monoamide
- Sulfuric diamide
- Sulfuric esteramide
- Sulfuric derivative
- Sulfonic acid
- Sulfonamide
- Sulfonic ester
- Sulfonic halide
- Sulfonic derivative
- Sulfinic acid
- Sulfinic amide
- Sulfinic ester
- Sulfinic halide
- Sulfinic derivative
- Sulfenic acid
- Sulfenic amide
- Sulfenic ester
- Sulfenic halide
- Sulfenic derivative
- II.3 Phosphorous
- Phosphine
- Phosphine oxide
- Phosphonium
- Phosphorylen
- Phosphonic acid
- Phosphonic monoester
- Phosphonic diester
- Phosphonic monoamide
- Phosphonic diamide
- Phosphonic esteramide
- Phosphonic acid derivative
- Phosphoric acid
- Phosphoric monoester
- Phosphoric diester
- Phosphoric triester
- Phosphoric monoamide
- Phosphoric diamide
- Phosphoric triamide
- Phosphoric monoestermonoamide
- Phosphoric diestermonoamide
- Phosphoric monoesterdiamide
- Phosphoric acid derivative
- Phosphinic acid
- Phosphinic ester
- Phosphinic amide
- Phosphinic acid derivative
- Phosphonous acid
- Phosphonous monoester
- Phosphonous diester
- Phosphonous monoamide
- Phosphonous diamide
- Phosphonous esteramide
- Phosphonous derivatives
- Phosphinous acid
- Phosphinous ester
- Phosphinous amide
- Phosphinous derivatives
- II.4 Silicon
- Quart silane
- Non-quart silane
- Silylmonohalide
- Het trialkylsilane
- Dihet dialkylsilane
- Trihet alkylsilane
- Silicic acid derivative
- II.5 Boron
- Trialkylborane
- Boric acid derivatives
- Boronic acid derivative
- Borohydride
- Quaternary boron
Part III: Some Special Patterns
- III.1 Chains
- III.2 Rings
- Aromatic
- Heterocyclic
- Epoxide
- NH aziridine
- Spiro
- Annelated rings
- Bridged rings
- III.3 Sugars and Nucleosides/Nucleotides, Steroids
- Sugar pattern 1
- Sugar pattern 2
- Sugar pattern combi
- Sugar pattern 2 reducing
- Sugar pattern 2 alpha
- Sugar pattern 2 beta
- III.4 Everything else...
- Conjugated double bond
- Conjugated tripple bond
- Cis double bond
- Trans double bond
- Mixed anhydrides
- Halogen on hetero
- Halogen multi subst
- Trifluoromethyl
- C ONS bond
- Charged
- Anion
- Kation
- Salt
- 1,3-Tautomerizable
- 1,5-Tautomerizable
- Rotatable bond
- Michael acceptor
- Dicarbodiazene
- CH-acidic
- CH-acidic strong
- Chiral center specified