Chembase list of 866358 unique molecular structures

methyl(piperidin-3-ylmethyl)(pyridin-3-ylmethyl)amine

$$$$ Data

M. F.

C13H21N3

Suppliers	Catalog Number
Enamine	EN300-66928

Database	Data ID
PubChem	16768130

M. W.

219.32594

CAS

Similarity

N/A

ID: 269352

2-ethyl-N-(2-ethylcyclohexyl)cyclohexan-1-amine

$$$$ Data

M. F.

C16H31N

Suppliers	Catalog Number
Enamine	EN300-66931

Database	Data ID
PubChem	50987859

M. W.

237.42404

CAS

Similarity

N/A

ID: 269353

4-(3-chloropropyl)-1-methyl-1H-pyrazole hydrochloride

$$$$ Data

M. F.

C7H12Cl2N2

Suppliers	Catalog Number
Enamine	EN300-66932

Database	Data ID
PubChem	50988495

M. W.

195.08958

CAS

Similarity

N/A

ID: 269354

4-chloro-N-(4-methylphenyl)-3-nitrobenzamide

$$$$ Data

M. F.

C14H11ClN2O3

Suppliers	Catalog Number
Enamine	EN300-66933

Database	Data ID
PubChem	711279

M. W.

290.70174

CAS

Similarity

N/A

ID: 269355

3-formylbenzamide

$$$$ Data

M. F.

C8H7NO2

Suppliers	Catalog Number
Enamine	EN300-66935

Database	Data ID
PubChem	10630670

M. W.

149.14668

CAS

Similarity

N/A

ID: 269356

2-methyl-1H-imidazole-5-sulfonyl chloride

$$$$ Data

M. F.

C4H5ClN2O2S

Suppliers	Catalog Number
Enamine	EN300-66958

Database	Data ID
PubChem	10583549

M. W.

180.6127

CAS

Similarity

N/A

ID: 269357

2-(naphthalen-2-yl)pyrrolidine hydrochloride

$$$$ Data

M. F.

C14H16ClN

Suppliers	Catalog Number
Enamine	EN300-66962

Database	Data ID
PubChem	44630993

M. W.

233.73654

CAS

Similarity

N/A

ID: 269358

N-{2-[(4-hydroxyphenyl)sulfanyl]ethyl}acetamide

$$$$ Data

M. F.

C10H13NO2S

Suppliers	Catalog Number
Enamine	EN300-66963

Database	Data ID
PubChem	124470

M. W.

211.28072

CAS

Similarity

N/A

ID: 269359

2-(3-bromopropoxy)naphthalene

$$$$ Data

M. F.

C13H13BrO

Suppliers	Catalog Number
Enamine	EN300-66965

Database	Data ID
PubChem	4113672

M. W.

265.14572

CAS

Similarity

N/A

ID: 269360

N-(3-fluorophenyl)-1,3-thiazolidine-4-carboxamide

$$$$ Data

M. F.

C10H11FN2OS

Suppliers	Catalog Number
Enamine	EN300-66966

Database	Data ID
PubChem	24694984

M. W.

226.2705432

CAS

Similarity

N/A

ID: 269361

5-(4-propanoylphenoxy)pentanoic acid

$$$$ Data

M. F.

C14H18O4

Suppliers	Catalog Number
Enamine	EN300-66967

Database	Data ID
PubChem	28971707

M. W.

250.29032

CAS

Similarity

N/A

ID: 269362

2-(3-fluorophenyl)-2-(methylamino)ethan-1-ol

$$$$ Data

M. F.

C9H12FNO

Suppliers	Catalog Number
Enamine	EN300-66968

Database	Data ID
PubChem	50989040

M. W.

169.1960832

CAS

Similarity

N/A

ID: 269363

4-(dimethylamino)-3-fluorobenzaldehyde

$$$$ Data

M. F.

C9H10FNO

Suppliers	Catalog Number
Enamine	EN300-66969

Database	Data ID
PubChem	28603781

M. W.

167.1802032

CAS

Similarity

N/A

ID: 269364

2,3-dihydro-1H-indene-1-carboxylic acid

$$$$ Data More

M. F.

C10H10O2

Suppliers	Catalog Number
ChemBridge	4039605
Enamine	EN300-66970
Bide Pharmatech	BD59072

Database	Data ID
PubChem	85728

M. W.

162.1852

CAS

14381-42-1

Similarity

N/A

ID: 269365

2-amino-2-cyclopentylacetic acid hydrochloride

$$$$ Data

M. F.

C7H14ClNO2

Suppliers	Catalog Number
Enamine	EN300-66971

Database	Data ID
PubChem	18926642

M. W.

179.64456

CAS

Similarity

N/A

ID: 269366

N-(3-methylbutyl)-1,3-thiazolidine-4-carboxamide

$$$$ Data

M. F.

C9H18N2OS

Suppliers	Catalog Number
Enamine	EN300-66972

Database	Data ID
PubChem	22443888

M. W.

202.31702

CAS

Similarity

N/A

ID: 269367

[4-(dimethylamino)-3-fluorophenyl]methanol

$$$$ Data

M. F.

C9H12FNO

Suppliers	Catalog Number
Enamine	EN300-66973

Database	Data ID
PubChem	33788166

M. W.

169.1960832

CAS

Similarity

N/A

ID: 269368

2-(4-methoxy-3-nitrophenyl)acetic acid

$$$$ Data

M. F.

C9H9NO5

Suppliers	Catalog Number
Enamine	EN300-66974

Database	Data ID
PubChem	4330521

M. W.

211.17146

CAS

Similarity

N/A

ID: 269369

4-({[(4-hydroxy-3,5-dimethylphenyl)methyl]amino}methyl)-2,6-dimethylphenol

$$$$ Data

M. F.

C18H23NO2

Suppliers	Catalog Number
Enamine	EN300-66999

Database	Data ID
PubChem	50987713

M. W.

285.38072

CAS

Similarity

N/A

ID: 269370

3,4-dichloro-N-(2-hydroxyphenyl)benzene-1-sulfonamide

$$$$ Data

M. F.

C12H9Cl2NO3S

Suppliers	Catalog Number
Enamine	EN300-67011

Database	Data ID
PubChem	2983003

M. W.

318.17576

CAS

Similarity

N/A

ID: 269371

3-(3-aminopropyl)-5,5-dimethylimidazolidine-2,4-dione

$$$$ Data

M. F.

C8H15N3O2

Suppliers	Catalog Number
Enamine	EN300-67013

Database	Data ID
PubChem	20121245

M. W.

185.2236

CAS

Similarity

N/A

ID: 269372

(3S)-3-amino-3-(2,6-difluorophenyl)propanoic acid

$$$$ Data

M. F.

C9H9F2NO2

Suppliers	Catalog Number
Enamine	EN300-67015

Database	Data ID
PubChem	40423878

M. W.

201.1700664

CAS

Similarity

N/A

ID: 269373

3-phenyl-1,3-diazinane-2,4-dione

$$$$ Data

M. F.

C10H10N2O2

Suppliers	Catalog Number
Enamine	EN300-67017

Database	Data ID
PubChem	13068935

M. W.

190.1986

CAS

Similarity

N/A

ID: 269374

N-(2-aminoethyl)pyridazin-3-amine

$$$$ Data

M. F.

C6H10N4

Suppliers	Catalog Number
Enamine	EN300-67019

Database	Data ID
PubChem	22118660

M. W.

138.1704

CAS

Similarity

N/A

ID: 269375

[3-(dimethylamino)propyl](diphenylmethyl)amine

$$$$ Data

M. F.

C18H24N2

Suppliers	Catalog Number
Enamine	EN300-67020

Database	Data ID
PubChem	28482961

M. W.

268.39656

CAS

Similarity

N/A

ID: 269376

3-chloro-6-(propan-2-ylsulfanyl)pyridazine

$$$$ Data

M. F.

C7H9ClN2S

Suppliers	Catalog Number
Enamine	EN300-67022

Database	Data ID
PubChem	22425634

M. W.

188.67776

CAS

Similarity

N/A

ID: 269377

2-(oxolan-2-ylmethanesulfonyl)acetic acid

$$$$ Data

M. F.

C7H12O5S

Suppliers	Catalog Number
Enamine	EN300-67023

Database	Data ID
PubChem	24691557

M. W.

208.23218

CAS

Similarity

N/A

ID: 269378

cyclopentylmethanethiol

$$$$ Data

M. F.

C6H12S

Suppliers	Catalog Number
Enamine	EN300-67024

Database	Data ID
PubChem	260914

M. W.

116.22448

CAS

Similarity

N/A

ID: 269379

1-methyl-2,4-dioxo-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-6-sulfonyl chloride

$$$$ Data

M. F.

C8H6ClN3O4S

Suppliers	Catalog Number
Enamine	EN300-67025

Database	Data ID
PubChem	50988977

M. W.

275.66894

CAS

Similarity

N/A

ID: 269380

N-(2,4-dimethylphenyl)-1,3-thiazolidine-4-carboxamide

$$$$ Data

M. F.

C12H16N2OS

Suppliers	Catalog Number
Enamine	EN300-67026

Database	Data ID
PubChem	24691164

M. W.

236.33324

CAS

Similarity

N/A

ID: 269381

2-amino-2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethan-1-ol hydrochloride

$$$$ Data

M. F.

C10H12ClN3O2

Suppliers	Catalog Number
Enamine	EN300-67027

Database	Data ID
PubChem	50988652

M. W.

241.67418

CAS

Similarity

N/A

ID: 269382

N-(2-fluorophenyl)-1,3-thiazolidine-4-carboxamide

$$$$ Data

M. F.

C10H11FN2OS

Suppliers	Catalog Number
Enamine	EN300-67028

Database	Data ID
PubChem	24698693

M. W.

226.2705432

CAS

Similarity

N/A

ID: 269383

N-(1-{4-[(3-methylphenyl)methoxy]phenyl}ethylidene)hydroxylamine

$$$$ Data

M. F.

C16H17NO2

Suppliers	Catalog Number
Enamine	EN300-67031

Database	Data ID
PubChem	43095910

M. W.

255.31168

CAS

Similarity

N/A

ID: 269384

1-{4-[(3-methylphenyl)methoxy]phenyl}ethan-1-one

$$$$ Data

M. F.

C16H16O2

Suppliers	Catalog Number
Enamine	EN300-67032

Database	Data ID
PubChem	5200303

M. W.

240.29704

CAS

Similarity

N/A

ID: 269385

1-{[3-(trifluoromethyl)phenyl]methyl}-1H-1,3-benzodiazol-2-amine

$$$$ Data

M. F.

C15H12F3N3

Suppliers	Catalog Number
Enamine	EN300-67033

Database	Data ID
PubChem	43148779

M. W.

291.2710896

CAS

Similarity

N/A

ID: 269386

5-phenylpentan-1-amine

$$$$ Data

M. F.

C11H17N

Suppliers	Catalog Number
Enamine	EN300-67034
A&J Pharmtech	AJA-O40218

Database	Data ID
PubChem	140275

M. W.

163.25938

CAS

17734-21-3

Similarity

N/A

ID: 269387

4-[(7-chloroquinolin-4-yl)oxy]-3-fluoroaniline

$$$$ Data

M. F.

C15H10ClFN2O

Suppliers	Catalog Number
Enamine	EN300-67037

Database	Data ID
PubChem	43259365

M. W.

288.7041032

CAS

Similarity

N/A

ID: 269388

1,1-dioxo-1λ⁶,4-thiomorpholine-4-carbothioamide

$$$$ Data

M. F.

C5H10N2O2S2

Suppliers	Catalog Number
Enamine	EN300-67039

Database	Data ID
PubChem	43581571

M. W.

194.2751

CAS

Similarity

N/A

ID: 269389

(2,3-dihydro-1,4-benzodioxin-5-ylmethyl)(ethyl)amine hydrochloride

$$$$ Data

M. F.

C11H16ClNO2

Suppliers	Catalog Number
Enamine	EN300-67048

Database	Data ID
PubChem	50988237

M. W.

229.70324

CAS

Similarity

N/A

ID: 269390

(5-fluoro-2-nitrophenyl)methanamine hydrochloride

$$$$ Data

M. F.

C7H8ClFN2O2

Suppliers	Catalog Number
Enamine	EN300-67049

Database	Data ID
PubChem	50988697

M. W.

206.6020232

CAS

Similarity

N/A

ID: 269391

3-(1H-indol-3-yl)propanamide

$$$$ Data

M. F.

C11H12N2O

Suppliers	Catalog Number
Enamine	EN300-67051

Database	Data ID
PubChem	351791

M. W.

188.22578

CAS

Similarity

N/A

ID: 269392

2-(dimethylamino)acetohydrazide

$$$$ Data

M. F.

C4H11N3O

Suppliers	Catalog Number
Enamine	EN300-67052

Database	Data ID
PubChem	68319

M. W.

117.14964

CAS

Similarity

N/A

ID: 269393

3,4-dimethylpentanoic acid

$$$$ Data

M. F.

C7H14O2

Suppliers	Catalog Number
Enamine	EN300-67053

Database	Data ID
PubChem	226113

M. W.

130.18486

CAS

Similarity

N/A

ID: 269394

3,5-dimethylhexanoic acid

$$$$ Data

M. F.

C8H16O2

Suppliers	Catalog Number
Enamine	EN300-67054

Database	Data ID
PubChem	12830075

M. W.

144.21144

CAS

Similarity

N/A

ID: 269395

3-[(methylsulfanyl)methyl]benzonitrile

$$$$ Data

M. F.

C9H9NS

Suppliers	Catalog Number
Enamine	EN300-67055

Database	Data ID
PubChem	20649704

M. W.

163.23946

CAS

Similarity

N/A

ID: 269396

trifluoroacetohydrazide

$$$$ Data

M. F.

C2H3F3N2O

Suppliers	Catalog Number
Enamine	EN300-67056
Bide Pharmatech	BD155286
A&J Pharmtech	AJA-O39439

Database	Data ID
PubChem	229753

M. W.

128.0532296

CAS

1538-08-5

Similarity

N/A

ID: 269397

3-(1-aminoethyl)benzonitrile

$$$$ Data

M. F.

C9H10N2

Suppliers	Catalog Number
Enamine	EN300-67057

Database	Data ID
PubChem	15282287

M. W.

146.1891

CAS

Similarity

N/A

ID: 269398

4-(butan-2-yl)-1,3-thiazol-2-amine

$$$$ Data

M. F.

C7H12N2S

Suppliers	Catalog Number
Enamine	EN300-67058

Database	Data ID
PubChem	13253356

M. W.

156.24858

CAS

Similarity

N/A

ID: 269399

2-[2-(2,2,2-trifluoroethoxy)phenoxy]acetic acid

$$$$ Data

M. F.

C10H9F3O4

Suppliers	Catalog Number
Enamine	EN300-67061

Database	Data ID
PubChem	50990572

M. W.

250.1712696

CAS

Similarity

N/A

ID: 269400

1-(4-chlorophenyl)-2-(piperazin-1-yl)ethan-1-one dihydrochloride

$$$$ Data

M. F.

C12H17Cl3N2O

Suppliers	Catalog Number
Enamine	EN300-67062

Database	Data ID
PubChem	50988351

M. W.

311.63518

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