Chembase list of 866358 unique molecular structures

3-amino-N-(5-chloro-2-methoxyphenyl)propanamide

$$$$ Data

M. F.

C10H13ClN2O2

Suppliers	Catalog Number
Enamine	EN300-98462

Database	Data ID
PubChem	22692047

M. W.

228.67542

CAS

Similarity

N/A

ID: 286052

N'-hydroxy-2-methoxypropanimidamide

$$$$ Data

M. F.

C4H10N2O2

Suppliers	Catalog Number
ChemBridge	4045625
Enamine	EN300-98463

Database	Data ID
PubChem	59864337

M. W.

118.1344

CAS

Similarity

N/A

ID: 286053

1-[4-(pyridin-3-yl)phenyl]ethan-1-amine

$$$$ Data

M. F.

C13H14N2

Suppliers	Catalog Number
Enamine	EN300-98464

Database	Data ID
PubChem	61025615

M. W.

198.26366

CAS

Similarity

N/A

ID: 286054

4-(4-hydroxyphenoxy)benzonitrile

$$$$ Data

M. F.

C13H9NO2

Suppliers	Catalog Number
Enamine	EN300-98465

Database	Data ID
PubChem	4522712

M. W.

211.21606

CAS

Similarity

N/A

ID: 286055

1-{2-bromo-5-methyl-[1,2,4]triazolo[3,2-b][1,3]oxazol-6-yl}ethan-1-one

$$$$ Data

M. F.

C7H6BrN3O2

Suppliers	Catalog Number
Enamine	EN300-98466

Database	Data ID
PubChem	73994796

M. W.

244.04544

CAS

Similarity

N/A

ID: 286056

1-(oxan-4-yl)piperazine

$$$$ Data

M. F.

C9H18N2O

Suppliers	Catalog Number
ChemBridge	4032671
Enamine	EN300-98471

Database	Data ID
PubChem	21942315

M. W.

170.25202

CAS

398137-19-4

Similarity

N/A

ID: 286057

[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]methanamine

$$$$ Data

M. F.

C6H11N3S

Suppliers	Catalog Number
Enamine	EN300-98474
A&J Pharmtech	AJA-O19296

Database	Data ID
PubChem	64985314

M. W.

157.23664

CAS

Similarity

N/A

ID: 286058

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

$$$$ Data

M. F.

C7H13N3O2

Suppliers	Catalog Number
Enamine	EN300-98475

Database	Data ID
PubChem	72110932

M. W.

171.19702

CAS

Similarity

N/A

ID: 286059

1-(isocyanatomethyl)-1-[(methylsulfanyl)methyl]cyclopropane

$$$$ Data

M. F.

C7H11NOS

Suppliers	Catalog Number
Enamine	EN300-98477

Database	Data ID
PubChem	73994797

M. W.

157.23334

CAS

Similarity

N/A

ID: 286060

4-(chloromethyl)-2-(1-methoxyethyl)-1,3-thiazole

$$$$ Data

M. F.

C7H10ClNOS

Suppliers	Catalog Number
Enamine	EN300-98478

Database	Data ID
PubChem	61695932

M. W.

191.6784

CAS

Similarity

N/A

ID: 286061

5-(chloromethyl)-3-(1-methoxyethyl)-1,2,4-oxadiazole

$$$$ Data

M. F.

C6H9ClN2O2

Suppliers	Catalog Number
Enamine	EN300-98479

Database	Data ID
PubChem	66490777

M. W.

176.60086

CAS

Similarity

N/A

ID: 286062

(1-chloroethyl)cyclopropane

$$$$ Data

M. F.

C5H9Cl

Suppliers	Catalog Number
Enamine	EN300-98480

Database	Data ID
PubChem	12627052

M. W.

104.57796

CAS

Similarity

N/A

ID: 286063

ethyl 1-(pyrazin-2-yl)piperidine-4-carboxylate

$$$$ Data

M. F.

C12H17N3O2

Suppliers	Catalog Number
Enamine	EN300-98481

Database	Data ID
PubChem	2867731

M. W.

235.28228

CAS

Similarity

N/A

ID: 286064

2-(isothiocyanatomethyl)-4-(trifluoromethyl)-1,3-thiazole

$$$$ Data

M. F.

C6H3F3N2S2

Suppliers	Catalog Number
Enamine	EN300-98484

Database	Data ID
PubChem	73994798

M. W.

224.2266296

CAS

Similarity

N/A

ID: 286065

[2-(2-methylmorpholin-4-yl)pyridin-4-yl]methanamine

$$$$ Data

M. F.

C11H17N3O

Suppliers	Catalog Number
Enamine	EN300-98485

Database	Data ID
PubChem	16786106

M. W.

207.27218

CAS

Similarity

N/A

ID: 286066

3,5-dioxopiperazine-1-carbaldehyde

$$$$ Data

M. F.

C5H6N2O3

Suppliers	Catalog Number
Enamine	EN300-98486

Database	Data ID
PubChem	1902996

M. W.

142.11274

CAS

Similarity

N/A

ID: 286067

2-{8-[(tert-butoxy)carbonyl]-8-azabicyclo[3.2.1]octan-3-yl}acetic acid

$$$$ Data

M. F.

C14H23NO4

Suppliers	Catalog Number
Enamine	EN300-98488

Database	Data ID
PubChem	70224725

M. W.

269.33672

CAS

Similarity

N/A

ID: 286068

1-(1-benzyl-1H-pyrazol-4-yl)ethan-1-one

$$$$ Data

M. F.

C12H12N2O

Suppliers	Catalog Number
Enamine	EN300-98490

Database	Data ID
PubChem	53423566

M. W.

200.23648

CAS

Similarity

N/A

ID: 286069

2-(1,1-dioxo-1λ⁶,4-thiomorpholin-4-yl)-2-methylpropanoic acid

$$$$ Data

M. F.

C8H15NO4S

Suppliers	Catalog Number
Enamine	EN300-98498

Database	Data ID
PubChem	61266128

M. W.

221.274

CAS

Similarity

N/A

ID: 286070

4,4-difluoro-2-phenylbutanoic acid

$$$$ Data

M. F.

C10H10F2O2

Suppliers	Catalog Number
Enamine	EN300-98510

Database	Data ID
PubChem	73994799

M. W.

200.1820064

CAS

Similarity

N/A

ID: 286071

1-bromo-1,1-difluoro-3-nitropropan-2-ol

$$$$ Data

M. F.

C3H4BrF2NO3

Suppliers	Catalog Number
Enamine	EN300-98519

Database	Data ID
PubChem	73994800

M. W.

219.9695664

CAS

Similarity

N/A

ID: 286072

4-[(benzyloxy)carbonyl]morpholine-2-carboxylic acid

$$$$ Data

M. F.

C13H15NO5

Suppliers	Catalog Number
Enamine	EN300-98531

Database	Data ID
PubChem	53664523

M. W.

265.2619

CAS

Similarity

N/A

ID: 286073

benzyl 2-(hydrazinecarbonyl)morpholine-4-carboxylate

$$$$ Data

M. F.

C13H17N3O4

Suppliers	Catalog Number
Enamine	EN300-98532

Database	Data ID
PubChem	73994801

M. W.

279.29178

CAS

Similarity

N/A

ID: 286074

2-[2-(propan-2-yloxy)ethanesulfonamido]acetic acid

$$$$ Data

M. F.

C7H15NO5S

Suppliers	Catalog Number
Enamine	EN300-98544

Database	Data ID
PubChem	72110930

M. W.

225.2627

CAS

Similarity

N/A

ID: 286075

5-formylthiophene-3-carbonitrile

$$$$ Data

M. F.

C6H3NOS

Suppliers	Catalog Number
Enamine	EN300-98561

Database	Data ID
PubChem	12280009

M. W.

137.15912

CAS

Similarity

N/A

ID: 286076

3-amino-3-cyclohexylpropanamide hydrochloride

$$$$ Data

M. F.

C9H19ClN2O

Suppliers	Catalog Number
Enamine	EN300-98562

Database	Data ID
PubChem	72150192

M. W.

206.71296

CAS

Similarity

N/A

ID: 286077

1,1,1-trifluoro-3-(pyridin-2-yl)propan-2-amine

$$$$ Data

M. F.

C8H9F3N2

Suppliers	Catalog Number
Enamine	EN300-98563

Database	Data ID
PubChem	43139092

M. W.

190.1656696

CAS

Similarity

N/A

ID: 286078

1-ethyl-1H-imidazole-4-sulfonyl chloride

$$$$ Data

M. F.

C5H7ClN2O2S

Suppliers	Catalog Number
Enamine	EN300-98564

Database	Data ID
PubChem	15100266

M. W.

194.63928

CAS

Similarity

N/A

ID: 286079

(2-benzylphenyl)boronic acid

$$$$ Data

M. F.

C13H13BO2

Suppliers	Catalog Number
Enamine	EN300-98565

Database	Data ID
PubChem	62252966

M. W.

212.05212

CAS

Similarity

N/A

ID: 286080

2-(3-cyanophenyl)cyclopropane-1-carboxylic acid

$$$$ Data

M. F.

C11H9NO2

Suppliers	Catalog Number
Enamine	EN300-98566

Database	Data ID
PubChem	43810275

M. W.

187.19466

CAS

Similarity

N/A

ID: 286081

2,6-dimethyl-3,4-dihydro-2H-1,4-benzoxazin-3-one

$$$$ Data

M. F.

C10H11NO2

Suppliers	Catalog Number
Enamine	EN300-98567

Database	Data ID
PubChem	4054366

M. W.

177.19984

CAS

Similarity

N/A

ID: 286082

4-benzyl-2-nitrophenol

$$$$ Data

M. F.

C13H11NO3

Suppliers	Catalog Number
Enamine	EN300-98568

Database	Data ID
PubChem	786374

M. W.

229.23134

CAS

Similarity

N/A

ID: 286083

2-benzylazetidine hydrochloride

$$$$ Data

M. F.

C10H14ClN

Suppliers	Catalog Number
Enamine	EN300-98570

Database	Data ID
PubChem	73994802

M. W.

183.67786

CAS

Similarity

N/A

ID: 286084

3-amino-5-methanesulfonylbenzoic acid

$$$$ Data

M. F.

C8H9NO4S

Suppliers	Catalog Number
Enamine	EN300-98571

Database	Data ID
PubChem	18952506

M. W.

215.22636

CAS

Similarity

N/A

ID: 286085

[2,2-dimethyl-3-(methylamino)propyl](methyl)amine dihydrochloride

$$$$ Data

M. F.

C7H20Cl2N2

Suppliers	Catalog Number
Enamine	EN300-98573

Database	Data ID
PubChem	72135030

M. W.

203.1531

CAS

Similarity

N/A

ID: 286086

{[2-(benzyloxy)-3-bromophenyl]methyl}(methyl)amine hydrochloride

$$$$ Data

M. F.

C15H17BrClNO

Suppliers	Catalog Number
Enamine	EN300-98575

Database	Data ID
PubChem	73994803

M. W.

342.65858

CAS

Similarity

N/A

ID: 286087

2-chloro-N-methyl-N-(propan-2-yl)propanamide

$$$$ Data

M. F.

C7H14ClNO

Suppliers	Catalog Number
Enamine	EN300-98578

Database	Data ID
PubChem	16781557

M. W.

163.64516

CAS

Similarity

N/A

ID: 286088

3-(ethoxymethyl)pyrrolidine

$$$$ Data

M. F.

C7H15NO

Suppliers	Catalog Number
Enamine	EN300-98579

Database	Data ID
PubChem	45075569

M. W.

129.2001

CAS

Similarity

N/A

ID: 286089

1-ethyl-1H-imidazole-5-sulfonyl chloride

$$$$ Data

M. F.

C5H7ClN2O2S

Suppliers	Catalog Number
Enamine	EN300-98580

Database	Data ID
PubChem	73994804

M. W.

194.63928

CAS

Similarity

N/A

ID: 286090

1-(2,3,4-trimethoxybenzoyl)piperazine

$$$$ Data

M. F.

C14H20N2O4

Suppliers	Catalog Number
Enamine	EN300-98581

Database	Data ID
PubChem	19841192

M. W.

280.3196

CAS

Similarity

N/A

ID: 286091

ethyl(pyrrolidin-3-ylmethyl)(2,2,2-trifluoroethyl)amine

$$$$ Data

M. F.

C9H17F3N2

Suppliers	Catalog Number
Enamine	EN300-98582

Database	Data ID
PubChem	62370721

M. W.

210.2398896

CAS

Similarity

N/A

ID: 286092

2-(2-methylpropyl)-1H-1,3-benzodiazole-4-carboxylic acid

$$$$ Data

M. F.

C12H14N2O2

Suppliers	Catalog Number
Enamine	EN300-98583

Database	Data ID
PubChem	63032819

M. W.

218.25176

CAS

Similarity

N/A

ID: 286093

3-amino-2-[(3,5-dimethoxyphenyl)methyl]propan-1-ol

$$$$ Data

M. F.

C12H19NO3

Suppliers	Catalog Number
Enamine	EN300-98584

Database	Data ID
PubChem	43196827

M. W.

225.28416

CAS

Similarity

N/A

ID: 286094

ethyl (2R)-2-(methylamino)propanoate

$$$$ Data

M. F.

C6H13NO2

Suppliers	Catalog Number
Enamine	EN300-98585

Database	Data ID
PubChem	13353060

M. W.

131.17292

CAS

Similarity

N/A

ID: 286095

4-(chloromethyl)-2-methoxy-1-nitrobenzene

$$$$ Data

M. F.

C8H8ClNO3

Suppliers	Catalog Number
Enamine	EN300-98586

Database	Data ID
PubChem	22051619

M. W.

201.60702

CAS

Similarity

N/A

ID: 286096

1-(4-aminopyridin-3-yl)ethan-1-one

$$$$ Data

M. F.

C7H8N2O

Suppliers	Catalog Number
Enamine	EN300-98607

Database	Data ID
PubChem	10773027

M. W.

136.15122

CAS

Similarity

N/A

ID: 286097

tert-butyl 3-(4-methyl-2,5-dioxoimidazolidin-4-yl)piperidine-1-carboxylate

$$$$ Data

M. F.

C14H23N3O4

Suppliers	Catalog Number
Enamine	EN300-98618

Database	Data ID
PubChem	73994805

M. W.

297.35012

CAS

Similarity

N/A

ID: 286098

3-(4-methyl-2,5-dioxoimidazolidin-4-yl)benzoic acid

$$$$ Data

M. F.

C11H10N2O4

Suppliers	Catalog Number
Enamine	EN300-98620

Database	Data ID
PubChem	58719580

M. W.

234.2081

CAS

Similarity

N/A

ID: 286099

6-azaspiro[3.4]octane

$$$$ Data

M. F.

C7H13N

Suppliers	Catalog Number
Enamine	EN300-98631

Database	Data ID
PubChem	20521843

M. W.

111.18482

CAS

Similarity

N/A

ID: 286100

2-(methylamino)-2-[4-(trifluoromethyl)phenyl]acetic acid hydrochloride

$$$$ Data

M. F.

C10H11ClF3NO2

Suppliers	Catalog Number
Enamine	EN300-98641

Database	Data ID
PubChem	72154357

M. W.

269.6480496

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