Chembase list of 866358 unique molecular structures

3-amino-1-(2-chlorophenyl)pyrrolidin-2-one

$$$$ Data

M. F.

C10H11ClN2O

Suppliers	Catalog Number
Enamine	EN300-73848

Database	Data ID
PubChem	54592702

M. W.

210.66014

CAS

Similarity

N/A

ID: 272952

1-(1-benzofuran-2-yl)-2-methylpropan-1-one

$$$$ Data

M. F.

C12H12O2

Suppliers	Catalog Number
Enamine	EN300-73849

Database	Data ID
PubChem	13148491

M. W.

188.22248

CAS

Similarity

N/A

ID: 272953

1-cyclohexyl-3-(1,2,3,4-tetrahydroquinolin-5-yl)urea

$$$$ Data

M. F.

C16H23N3O

Suppliers	Catalog Number
Enamine	EN300-73851

Database	Data ID
PubChem	20116981

M. W.

273.37332

CAS

Similarity

N/A

ID: 272954

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

$$$$ Data

M. F.

C11H12N2O2

Suppliers	Catalog Number
Enamine	EN300-73853

Database	Data ID
PubChem	13068936

M. W.

204.22518

CAS

Similarity

N/A

ID: 272955

N'-(2-chloroacetyl)cyclobutanecarbohydrazide

$$$$ Data

M. F.

C7H11ClN2O2

Suppliers	Catalog Number
Enamine	EN300-73857

Database	Data ID
PubChem	52908224

M. W.

190.62744

CAS

Similarity

N/A

ID: 272956

1-benzofuran-2-carbothioamide

$$$$ Data

M. F.

C9H7NOS

Suppliers	Catalog Number
Enamine	EN300-73858

Database	Data ID
PubChem	43140148

M. W.

177.22298

CAS

Similarity

N/A

ID: 272957

2-(4-oxo-1,4-dihydroquinolin-1-yl)acetamide

$$$$ Data

M. F.

C11H10N2O2

Suppliers	Catalog Number
Enamine	EN300-73859

Database	Data ID
PubChem	43840085

M. W.

202.2093

CAS

Similarity

N/A

ID: 272958

1-(1H-1,2,3,4-tetrazol-5-yl)propan-1-amine

$$$$ Data

M. F.

C4H9N5

Suppliers	Catalog Number
Enamine	EN300-73861

Database	Data ID
PubChem	566608

M. W.

127.14776

CAS

Similarity

N/A

ID: 272959

4-(5-methyl-1,3,4-oxadiazol-2-yl)butanoic acid

$$$$ Data

M. F.

C7H10N2O3

Suppliers	Catalog Number
Enamine	EN300-73864

Database	Data ID
PubChem	39236299

M. W.

170.1659

CAS

Similarity

N/A

ID: 272960

2-(1-benzofuran-2-yl)-1,3-thiazole-4-carboxylic acid

$$$$ Data

M. F.

C12H7NO3S

Suppliers	Catalog Number
Enamine	EN300-73870

Database	Data ID
PubChem	43140163

M. W.

245.25388

CAS

Similarity

N/A

ID: 272961

4-methylpentane-1,2-diamine

$$$$ Data

M. F.

C6H16N2

Suppliers	Catalog Number
Enamine	EN300-73871

Database	Data ID
PubChem	3064226

M. W.

116.20464

CAS

Similarity

N/A

ID: 272962

(1-amino-4-methylpentan-2-yl)(1-phenylethyl)amine

$$$$ Data

M. F.

C14H24N2

Suppliers	Catalog Number
Enamine	EN300-73872

Database	Data ID
PubChem	54592703

M. W.

220.35376

CAS

Similarity

N/A

ID: 272963

(1-aminopropan-2-yl)(benzyl)methylamine

$$$$ Data

M. F.

C11H18N2

Suppliers	Catalog Number
Enamine	EN300-73873

Database	Data ID
PubChem	16641861

M. W.

178.27402

CAS

Similarity

N/A

ID: 272964

[3-(aminomethyl)pentan-3-yl](1-phenylethyl)amine

$$$$ Data

M. F.

C14H24N2

Suppliers	Catalog Number
Enamine	EN300-73874

Database	Data ID
PubChem	54592704

M. W.

220.35376

CAS

Similarity

N/A

ID: 272965

1-[(2-chloro-4-fluorophenyl)methyl]piperidin-3-amine

$$$$ Data

M. F.

C12H16ClFN2

Suppliers	Catalog Number
Enamine	EN300-73876

Database	Data ID
PubChem	54592705

M. W.

242.7202432

CAS

Similarity

N/A

ID: 272966

1-[(2,6-difluorophenyl)methyl]piperidin-3-amine

$$$$ Data

M. F.

C12H16F2N2

Suppliers	Catalog Number
Enamine	EN300-73878

Database	Data ID
PubChem	54592706

M. W.

226.2656464

CAS

Similarity

N/A

ID: 272967

3-bromo-2-(2-methoxyethoxy)pyridine

$$$$ Data

M. F.

C8H10BrNO2

Suppliers	Catalog Number
Enamine	EN300-73879

Database	Data ID
PubChem	22591048

M. W.

232.0745

CAS

Similarity

N/A

ID: 272968

N-(4-hydroxyphenyl)cyclohexanecarboxamide

$$$$ Data

M. F.

C13H17NO2

Suppliers	Catalog Number
Enamine	EN300-73881

Database	Data ID
PubChem	4056004

M. W.

219.27958

CAS

Similarity

N/A

ID: 272969

2-(5-chloro-1-methyl-1H-1,3-benzodiazol-2-yl)ethan-1-amine hydrochloride

$$$$ Data

M. F.

C10H13Cl2N3

Suppliers	Catalog Number
Enamine	EN300-73885

Database	Data ID
PubChem	54592707

M. W.

246.13632

CAS

Similarity

N/A

ID: 272970

2,3-dihydro-1H-inden-1-ylmethanamine

$$$$ Data

M. F.

C10H13N

Suppliers	Catalog Number
Enamine	EN300-73886
Bide Pharmatech	BD58823
A&J Pharmtech	AJA-O24519

Database	Data ID
PubChem	14348692

M. W.

147.21692

CAS

54949-92-7

Similarity

N/A

ID: 272971

2-(3-ethylpiperidin-1-yl)-2-methylpropan-1-amine

$$$$ Data

M. F.

C11H24N2

Suppliers	Catalog Number
Enamine	EN300-73887

Database	Data ID
PubChem	43584343

M. W.

184.32166

CAS

Similarity

N/A

ID: 272972

3-ethyl-5-methylimidazolidine-2,4-dione

$$$$ Data

M. F.

C6H10N2O2

Suppliers	Catalog Number
Enamine	EN300-73890

Database	Data ID
PubChem	21719014

M. W.

142.1558

CAS

Similarity

N/A

ID: 272973

3-ethylimidazolidine-2,4-dione

$$$$ Data

M. F.

C5H8N2O2

Suppliers	Catalog Number
Enamine	EN300-73891

Database	Data ID
PubChem	13258388

M. W.

128.12922

CAS

Similarity

N/A

ID: 272974

2-{[(1-benzyl-1H-pyrazol-4-yl)methyl]amino}ethan-1-ol hydrochloride

$$$$ Data

M. F.

C13H18ClN3O

Suppliers	Catalog Number
Enamine	EN300-73894

Database	Data ID
PubChem	54592708

M. W.

267.75452

CAS

Similarity

N/A

ID: 272975

4-amino-1-(4-phenylpiperazin-1-yl)butan-1-one dihydrochloride

$$$$ Data

M. F.

C14H23Cl2N3O

Suppliers	Catalog Number
Enamine	EN300-73910

Database	Data ID
PubChem	54592709

M. W.

320.25792

CAS

Similarity

N/A

ID: 272976

2-({1-[4-(trifluoromethyl)phenyl]-1H-imidazol-2-yl}sulfanyl)acetic acid

$$$$ Data

M. F.

C12H9F3N2O2S

Suppliers	Catalog Number
Enamine	EN300-73912

Database	Data ID
PubChem	29063470

M. W.

302.2722696

CAS

Similarity

N/A

ID: 272977

5,6-dimethyl-7-[2-(pyridin-2-yl)ethyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine

$$$$ Data

M. F.

C15H17N5

Suppliers	Catalog Number
Enamine	EN300-73913

Database	Data ID
PubChem	43337057

M. W.

267.32898

CAS

Similarity

N/A

ID: 272978

1,4-diazepane-1-sulfonamide

$$$$ Data

M. F.

C5H13N3O2S

Suppliers	Catalog Number
Enamine	EN300-73914

Database	Data ID
PubChem	24705420

M. W.

179.24062

CAS

Similarity

N/A

ID: 272979

5,6-dimethyl-7-(pyridin-2-ylmethyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine

$$$$ Data

M. F.

C14H15N5

Suppliers	Catalog Number
Enamine	EN300-73915

Database	Data ID
PubChem	43337072

M. W.

253.3024

CAS

Similarity

N/A

ID: 272980

3-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)propan-1-amine dihydrochloride

$$$$ Data

M. F.

C8H16Cl2N4

Suppliers	Catalog Number
Enamine	EN300-73917

Database	Data ID
PubChem	54592710

M. W.

239.14544

CAS

Similarity

N/A

ID: 272981

N-(3-bromophenyl)-3-oxobutanamide

$$$$ Data

M. F.

C10H10BrNO2

Suppliers	Catalog Number
ChemBridge	6085252
Enamine	EN300-73918

Database	Data ID
PubChem	285615

M. W.

256.0959

CAS

61579-06-4

Similarity

N/A

ID: 272982

2-amino-N-(quinolin-3-yl)acetamide

$$$$ Data

M. F.

C11H11N3O

Suppliers	Catalog Number
Enamine	EN300-73922

Database	Data ID
PubChem	43704706

M. W.

201.22454

CAS

Similarity

N/A

ID: 272983

2-(2,4-dioxo-1,3-diazinan-1-yl)acetic acid

$$$$ Data

M. F.

C6H8N2O4

Suppliers	Catalog Number
Enamine	EN300-73924

Database	Data ID
PubChem	52908238

M. W.

172.13872

CAS

Similarity

N/A

ID: 272984

6-fluoro-3-(piperidin-4-yl)-1H-indole

$$$$ Data

M. F.

C13H15FN2

Suppliers	Catalog Number
Enamine	EN300-73927
A&J Pharmtech	AJA-O33855

Database	Data ID
PubChem	11096077

M. W.

218.2700032

CAS

76315-55-4

Similarity

N/A

ID: 272985

3-(chloromethyl)-1,2-dihydroquinolin-2-one

$$$$ Data

M. F.

C10H8ClNO

Suppliers	Catalog Number
Enamine	EN300-73928

Database	Data ID
PubChem	13342169

M. W.

193.62962

CAS

Similarity

N/A

ID: 272986

3-butyl-1-(1,2,3,4-tetrahydroquinolin-5-yl)urea

$$$$ Data

M. F.

C14H21N3O

Suppliers	Catalog Number
Enamine	EN300-73929

Database	Data ID
PubChem	28786614

M. W.

247.33604

CAS

Similarity

N/A

ID: 272987

1,3-bis[1-(2-methylpropyl)-1H-pyrazol-5-yl]urea

$$$$ Data

M. F.

C15H24N6O

Suppliers	Catalog Number
Enamine	EN300-73934

Database	Data ID
PubChem	52908243

M. W.

304.39066

CAS

Similarity

N/A

ID: 272988

N-(3-amino-4-methylphenyl)-2,2-dimethylpropanamide

$$$$ Data

M. F.

C12H18N2O

Suppliers	Catalog Number
Enamine	EN300-73937

Database	Data ID
PubChem	17607918

M. W.

206.28412

CAS

Similarity

N/A

ID: 272989

1-cyclohexyl-3-(1,2,3,4-tetrahydroquinolin-8-yl)urea

$$$$ Data

M. F.

C16H23N3O

Suppliers	Catalog Number
Enamine	EN300-73938

Database	Data ID
PubChem	20118378

M. W.

273.37332

CAS

Similarity

N/A

ID: 272990

4-ethenylpiperidine hydrochloride

$$$$ Data

M. F.

C7H14ClN

Suppliers	Catalog Number
Enamine	EN300-73939

Database	Data ID
PubChem	54592711

M. W.

147.64576

CAS

Similarity

N/A

ID: 272991

methyl 2-{[2-(tert-butoxy)-2-oxoethyl]amino}acetate

$$$$ Data

M. F.

C9H17NO4

Suppliers	Catalog Number
Enamine	EN300-73940

Database	Data ID
PubChem	21643695

M. W.

203.23558

CAS

Similarity

N/A

ID: 272992

4-cyclopropylmorpholine-2-carbonitrile

$$$$ Data

M. F.

C8H12N2O

Suppliers	Catalog Number
Enamine	EN300-73941

Database	Data ID
PubChem	54592712

M. W.

152.19368

CAS

Similarity

N/A

ID: 272993

benzyl(oxan-4-ylmethyl)amine

$$$$ Data

M. F.

C13H19NO

Suppliers	Catalog Number
Enamine	EN300-73942
A&J Pharmtech	AJA-O27267

Database	Data ID
PubChem	24730042

M. W.

205.29606

CAS

887978-20-3

Similarity

N/A

ID: 272994

4-[2-(dimethylamino)ethoxy]-N-methylaniline

$$$$ Data

M. F.

C11H18N2O

Suppliers	Catalog Number
Enamine	EN300-73943

Database	Data ID
PubChem	39202759

M. W.

194.27342

CAS

Similarity

N/A

ID: 272995

4-cyclohexylbutan-2-one

$$$$ Data

M. F.

C10H18O

Suppliers	Catalog Number
Enamine	EN300-73944

Database	Data ID
PubChem	536973

M. W.

154.24932

CAS

Similarity

N/A

ID: 272996

2,6-dichloro-3-(ethanesulfonyl)benzoic acid

$$$$ Data

M. F.

C9H8Cl2O4S

Suppliers	Catalog Number
Enamine	EN300-73946

Database	Data ID
PubChem	43140754

M. W.

283.12842

CAS

Similarity

N/A

ID: 272997

N-(3-aminopropyl)-3-fluorobenzamide hydrochloride

$$$$ Data

M. F.

C10H14ClFN2O

Suppliers	Catalog Number
Enamine	EN300-73953

Database	Data ID
PubChem	53516951

M. W.

232.6823632

CAS

Similarity

N/A

ID: 272998

2-(pyridin-4-yloxy)aniline

$$$$ Data

M. F.

C11H10N2O

Suppliers	Catalog Number
Enamine	EN300-73954

Database	Data ID
PubChem	3330580

M. W.

186.2099

CAS

Similarity

N/A

ID: 272999

2-amino-N-[2-(propan-2-yl)-1,3-benzoxazol-5-yl]butanamide

$$$$ Data

M. F.

C14H19N3O2

Suppliers	Catalog Number
Enamine	EN300-73957

Database	Data ID
PubChem	43711177

M. W.

261.31956

CAS

Similarity

N/A

ID: 273000

4-[(dimethyl-4H-1,2,4-triazol-3-yl)methoxy]aniline

$$$$ Data

M. F.

C11H14N4O

Suppliers	Catalog Number
Enamine	EN300-73958

Database	Data ID
PubChem	43524960

M. W.

218.25506

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