Chembase list of 866358 unique molecular structures

$$$$ Data

M. F.

C9H12OS

Suppliers	Catalog Number
Enamine	EN300-108961

Database	Data ID
PubChem	14954989

M. W.

168.25598

CAS

Similarity

N/A

ID: 238852

4-chlorobut-2-en-1-amine hydrochloride

$$$$ Data

M. F.

C4H9Cl2N

Suppliers	Catalog Number
Enamine	EN300-108969

Database	Data ID
PubChem	13619685

M. W.

142.02696

CAS

Similarity

N/A

ID: 238853

ethyl N-(4-amino-2-cyanophenyl)carbamate

$$$$ Data

M. F.

C10H11N3O2

Suppliers	Catalog Number
Enamine	EN300-108972

Database	Data ID
PubChem	43551362

M. W.

205.21324

CAS

Similarity

N/A

ID: 238854

(6-methylquinolin-3-yl)methanol

$$$$ Data

M. F.

C11H11NO

Suppliers	Catalog Number
Enamine	EN300-108980

Database	Data ID
PubChem	71685925

M. W.

173.21114

CAS

Similarity

N/A

ID: 238855

(6-methoxyquinolin-3-yl)methanol

$$$$ Data

M. F.

C11H11NO2

Suppliers	Catalog Number
Enamine	EN300-108981

Database	Data ID
PubChem	304667

M. W.

189.21054

CAS

Similarity

N/A

ID: 238856

(6-methoxyquinolin-3-yl)methanamine

$$$$ Data

M. F.

C11H12N2O

Suppliers	Catalog Number
Enamine	EN300-108982

Database	Data ID
PubChem	71695503

M. W.

188.22578

CAS

Similarity

N/A

ID: 238857

3-(aminomethyl)quinolin-6-ol

$$$$ Data

M. F.

C10H10N2O

Suppliers	Catalog Number
Enamine	EN300-108983

Database	Data ID
PubChem	71695364

M. W.

174.1992

CAS

Similarity

N/A

ID: 238858

2-(6-hydroxyquinolin-3-yl)acetonitrile

$$$$ Data

M. F.

C11H8N2O

Suppliers	Catalog Number
Enamine	EN300-108984

Database	Data ID
PubChem	71756248

M. W.

184.19402

CAS

Similarity

N/A

ID: 238859

2-(6-methoxyquinolin-3-yl)acetonitrile

$$$$ Data

M. F.

C12H10N2O

Suppliers	Catalog Number
Enamine	EN300-108985

Database	Data ID
PubChem	71756249

M. W.

198.2206

CAS

Similarity

N/A

ID: 238860

2-(6-methoxyquinolin-3-yl)ethan-1-amine

$$$$ Data

M. F.

C12H14N2O

Suppliers	Catalog Number
Enamine	EN300-108986

Database	Data ID
PubChem	71695371

M. W.

202.25236

CAS

Similarity

N/A

ID: 238861

3-(2-aminoethyl)quinolin-6-ol

$$$$ Data

M. F.

C11H12N2O

Suppliers	Catalog Number
Enamine	EN300-108987

Database	Data ID
PubChem	71695367

M. W.

188.22578

CAS

Similarity

N/A

ID: 238862

2-(6-hydroxyquinolin-3-yl)acetamide

$$$$ Data

M. F.

C11H10N2O2

Suppliers	Catalog Number
Enamine	EN300-108988

Database	Data ID
PubChem	71756250

M. W.

202.2093

CAS

Similarity

N/A

ID: 238863

2-(6-methoxyquinolin-3-yl)acetamide

$$$$ Data

M. F.

C12H12N2O2

Suppliers	Catalog Number
Enamine	EN300-108989

Database	Data ID
PubChem	71756251

M. W.

216.23588

CAS

Similarity

N/A

ID: 238864

N-(1,3-benzothiazol-2-ylmethyl)-2-chloroacetamide

$$$$ Data

M. F.

C10H9ClN2OS

Suppliers	Catalog Number
Enamine	EN300-10899

Database	Data ID
PubChem	3832721

M. W.

240.70926

CAS

Similarity

N/A

ID: 238865

(8-methylquinolin-3-yl)methanol

$$$$ Data

M. F.

C11H11NO

Suppliers	Catalog Number
Enamine	EN300-108991

Database	Data ID
PubChem	71685924

M. W.

173.21114

CAS

Similarity

N/A

ID: 238866

(8-methoxyquinolin-3-yl)methanol

$$$$ Data

M. F.

C11H11NO2

Suppliers	Catalog Number
Enamine	EN300-108992

Database	Data ID
PubChem	71685926

M. W.

189.21054

CAS

Similarity

N/A

ID: 238867

(6-methylquinolin-3-yl)methanamine

$$$$ Data

M. F.

C11H12N2

Suppliers	Catalog Number
Enamine	EN300-108993

Database	Data ID
PubChem	71695451

M. W.

172.22638

CAS

Similarity

N/A

ID: 238868

(8-methylquinolin-3-yl)methanamine

$$$$ Data

M. F.

C11H12N2

Suppliers	Catalog Number
Enamine	EN300-108994

Database	Data ID
PubChem	71695497

M. W.

172.22638

CAS

Similarity

N/A

ID: 238869

(8-methoxyquinolin-3-yl)methanamine

$$$$ Data

M. F.

C11H12N2O

Suppliers	Catalog Number
Enamine	EN300-108995

Database	Data ID
PubChem	71695502

M. W.

188.22578

CAS

Similarity

N/A

ID: 238870

2-(6-methylquinolin-3-yl)acetonitrile

$$$$ Data

M. F.

C12H10N2

Suppliers	Catalog Number
Enamine	EN300-108996

Database	Data ID
PubChem	71756252

M. W.

182.2212

CAS

Similarity

N/A

ID: 238871

2-(8-methylquinolin-3-yl)acetonitrile

$$$$ Data

M. F.

C12H10N2

Suppliers	Catalog Number
Enamine	EN300-108997

Database	Data ID
PubChem	71756253

M. W.

182.2212

CAS

Similarity

N/A

ID: 238872

2-(8-methoxyquinolin-3-yl)acetonitrile

$$$$ Data

M. F.

C12H10N2O

Suppliers	Catalog Number
Enamine	EN300-108998

Database	Data ID
PubChem	71756254

M. W.

198.2206

CAS

Similarity

N/A

ID: 238873

2-(6-methylquinolin-3-yl)ethan-1-amine

$$$$ Data

M. F.

C12H14N2

Suppliers	Catalog Number
Enamine	EN300-108999

Database	Data ID
PubChem	71695366

M. W.

186.25296

CAS

Similarity

N/A

ID: 238874

2-(8-methylquinolin-3-yl)ethan-1-amine

$$$$ Data

M. F.

C12H14N2

Suppliers	Catalog Number
Enamine	EN300-109001

Database	Data ID
PubChem	71695365

M. W.

186.25296

CAS

Similarity

N/A

ID: 238875

2-(8-methoxyquinolin-3-yl)ethan-1-amine

$$$$ Data

M. F.

C12H14N2O

Suppliers	Catalog Number
Enamine	EN300-109002

Database	Data ID
PubChem	71695370

M. W.

202.25236

CAS

Similarity

N/A

ID: 238876

2-(6-methylquinolin-3-yl)acetamide

$$$$ Data

M. F.

C12H12N2O

Suppliers	Catalog Number
Enamine	EN300-109003

Database	Data ID
PubChem	71756255

M. W.

200.23648

CAS

Similarity

N/A

ID: 238877

2-(8-methylquinolin-3-yl)acetamide

$$$$ Data

M. F.

C12H12N2O

Suppliers	Catalog Number
Enamine	EN300-109004

Database	Data ID
PubChem	71756256

M. W.

200.23648

CAS

Similarity

N/A

ID: 238878

2-(8-methoxyquinolin-3-yl)acetamide

$$$$ Data

M. F.

C12H12N2O2

Suppliers	Catalog Number
Enamine	EN300-109005

Database	Data ID
PubChem	71756257

M. W.

216.23588

CAS

Similarity

N/A

ID: 238879

5-bromo-6-methylpyridine-2,3-diamine

$$$$ Data

M. F.

C6H8BrN3

Suppliers	Catalog Number
Enamine	EN300-109006

Database	Data ID
PubChem	101022

M. W.

202.05182

CAS

Similarity

N/A

ID: 238880

6-bromo-5-methyl-3H-imidazo[4,5-b]pyridine-2-thiol

$$$$ Data

M. F.

C7H6BrN3S

Suppliers	Catalog Number
Enamine	EN300-109007

Database	Data ID
PubChem	5391173

M. W.

244.11164

CAS

Similarity

N/A

ID: 238881

6-bromo-2,5-dimethyl-3H-imidazo[4,5-b]pyridine

$$$$ Data

M. F.

C8H8BrN3

Suppliers	Catalog Number
Enamine	EN300-109009

Database	Data ID
PubChem	5418633

M. W.

226.07322

CAS

Similarity

N/A

ID: 238882

5-chloro-3-methyl-1-(2-methylpropyl)-1H-pyrazole-4-carbaldehyde

$$$$ Data

M. F.

C9H13ClN2O

Suppliers	Catalog Number
Enamine	EN300-10901

Database	Data ID
PubChem	5015913

M. W.

200.66532

CAS

Similarity

N/A

ID: 238883

2-{6-bromo-5-methyl-1H-imidazo[4,5-b]pyridin-2-yl}acetic acid

$$$$ Data

M. F.

C9H8BrN3O2

Suppliers	Catalog Number
Enamine	EN300-109010

Database	Data ID
PubChem	5708265

M. W.

270.08272

CAS

Similarity

N/A

ID: 238884

4-{2-[4-oxo-2-(pyrrolidin-1-yl)-4,5-dihydro-1,3-thiazol-5-yl]acetamido}benzoic a...

$$$$ Data

M. F.

C16H17N3O4S

Suppliers	Catalog Number
Enamine	EN300-10902

Database	Data ID
PubChem	5009751

M. W.

347.38888

CAS

Similarity

N/A

ID: 238885

5-bromo-4-chloro-6-methylpyridine-3-carboxylic acid

$$$$ Data

M. F.

C7H5BrClNO2

Suppliers	Catalog Number
Enamine	EN300-109027

Database	Data ID
PubChem	54516929

M. W.

250.4771

CAS

Similarity

N/A

ID: 238886

N-[1-(4-bromophenyl)propyl]-2-chloroacetamide

$$$$ Data

M. F.

C11H13BrClNO

Suppliers	Catalog Number
Enamine	EN300-10903

Database	Data ID
PubChem	4982836

M. W.

290.58402

CAS

Similarity

N/A

ID: 238887

1-N-cyclopentyl-1-N-methylbenzene-1,2-diamine

$$$$ Data

M. F.

C12H18N2

Suppliers	Catalog Number
Enamine	EN300-109030

Database	Data ID
PubChem	43266943

M. W.

190.28472

CAS

Similarity

N/A

ID: 238888

5-methyl-1,3-oxazolidin-2-one

$$$$ Data

M. F.

C4H7NO2

Suppliers	Catalog Number
ChemBridge	4043936
Enamine	EN300-109031

Database	Data ID
PubChem	136837

M. W.

101.10388

CAS

1072-70-4

Similarity

N/A

ID: 238889

2-(pyrrolidin-3-yloxy)pyridine

$$$$ Data

M. F.

C9H12N2O

Suppliers	Catalog Number
Enamine	EN300-109032

Database	Data ID
PubChem	18337160

M. W.

164.20438

CAS

Similarity

N/A

ID: 238890

(2,2-dimethylpropyl)(2-methylpropyl)amine

$$$$ Data

M. F.

C9H21N

Suppliers	Catalog Number
Enamine	EN300-109034

Database	Data ID
PubChem	21481394

M. W.

143.26974

CAS

Similarity

N/A

ID: 238891

5-[(dipropylamino)methyl]-1,2-oxazole-3-carboxylic acid hydrochloride

$$$$ Data

M. F.

C11H19ClN2O3

Suppliers	Catalog Number
Enamine	EN300-109035

Database	Data ID
PubChem	71756258

M. W.

262.73316

CAS

Similarity

N/A

ID: 238892

4-chloro-1-N-(cyclohexylmethyl)benzene-1,2-diamine

$$$$ Data

M. F.

C13H19ClN2

Suppliers	Catalog Number
Enamine	EN300-109036

Database	Data ID
PubChem	43371541

M. W.

238.75636

CAS

Similarity

N/A

ID: 238893

1-(3-bromophenyl)-5-methyl-1H-pyrazole

$$$$ Data

M. F.

C10H9BrN2

Suppliers	Catalog Number
Enamine	EN300-109037

Database	Data ID
PubChem	53415542

M. W.

237.09586

CAS

Similarity

N/A

ID: 238894

2-(2,2-difluoroethoxy)aniline

$$$$ Data

M. F.

C8H9F2NO

Suppliers	Catalog Number
Enamine	EN300-109038

Database	Data ID
PubChem	19627871

M. W.

173.1599664

CAS

Similarity

N/A

ID: 238895

thiolan-3-ylmethanol

$$$$ Data

M. F.

C5H10OS

Suppliers	Catalog Number
Enamine	EN300-109039

Database	Data ID
PubChem	20624486

M. W.

118.1973

CAS

Similarity

N/A

ID: 238896

2-chloro-N-[2-(quinolin-8-yl)ethyl]acetamide hydrochloride

$$$$ Data

M. F.

C13H14Cl2N2O

Suppliers	Catalog Number
Enamine	EN300-109043

Database	Data ID
PubChem	71756259

M. W.

285.16906

CAS

Similarity

N/A

ID: 238897

5-sulfanylpentanoic acid

$$$$ Data

M. F.

C5H10O2S

Suppliers	Catalog Number
Enamine	EN300-109049

Database	Data ID
PubChem	10909614

M. W.

134.1967

CAS

Similarity

N/A

ID: 238898

2-(4-aminooxan-4-yl)ethan-1-ol

$$$$ Data

M. F.

C7H15NO2

Suppliers	Catalog Number
Enamine	EN300-109050

Database	Data ID
PubChem	65240250

M. W.

145.1995

CAS

Similarity

N/A

ID: 238899

2,3-dichloro-1-benzothiophene

$$$$ Data

M. F.

C8H4Cl2S

Suppliers	Catalog Number
Enamine	EN300-109051

Database	Data ID
PubChem	79217

M. W.

203.08836

CAS

Similarity

N/A

ID: 238900

tert-butyl N-(2-bromothiophen-3-yl)carbamate

$$$$ Data

M. F.

C9H12BrNO2S

Suppliers	Catalog Number
Enamine	EN300-109052

Database	Data ID
PubChem	13164363

M. W.

278.16608

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