Chembase list of 866358 unique molecular structures

ID: 241951

2-chloro-3-(chloromethyl)-7,8-dimethylquinoline

$$$$ Data

M. F.

C12H11Cl2N

Suppliers	Catalog Number
Enamine	EN300-11508
A&J Pharmtech	AJA-O30837

Database	Data ID
PubChem	2442996

M. W.

240.12844

CAS

794582-35-7

Similarity

N/A

ID: 241952

2,3,5,6-tetramethylbenzene-1-sulfinic acid

$$$$ Data

M. F.

C10H14O2S

Suppliers	Catalog Number
Enamine	EN300-11509

Database	Data ID
PubChem	2442988

M. W.

198.28196

CAS

Similarity

N/A

ID: 241953

2-(2-methoxybenzenesulfonamido)-4-(methylsulfanyl)butanoic acid

$$$$ Data

M. F.

C12H17NO5S2

Suppliers	Catalog Number
Enamine	EN300-11510

Database	Data ID
PubChem	4961631

M. W.

319.39708

CAS

Similarity

N/A

ID: 241954

1,2,3,4-tetrahydroquinoline-7-sulfonic acid

$$$$ Data

M. F.

C9H11NO3S

Suppliers	Catalog Number
Enamine	EN300-115100

Database	Data ID
PubChem	13750913

M. W.

213.25354

CAS

Similarity

N/A

ID: 241955

2,3-dihydro-1-benzofuran-3-carbonyl chloride

$$$$ Data

M. F.

C9H7ClO2

Suppliers	Catalog Number
Enamine	EN300-115102

Database	Data ID
PubChem	64132554

M. W.

182.60368

CAS

Similarity

N/A

ID: 241956

N-methylpyrrolidine-3-sulfonamide hydrochloride

$$$$ Data

M. F.

C5H13ClN2O2S

Suppliers	Catalog Number
Enamine	EN300-115103

Database	Data ID
PubChem	71756912

M. W.

200.68692

CAS

Similarity

N/A

ID: 241957

N-(2-amino-2-phenylethyl)-1-methyl-1H-pyrrole-3-sulfonamide

$$$$ Data

M. F.

C13H17N3O2S

Suppliers	Catalog Number
Enamine	EN300-115104

Database	Data ID
PubChem	43605633

M. W.

279.35798

CAS

Similarity

N/A

ID: 241958

1-(3-ethylpyridin-4-yl)ethan-1-amine

$$$$ Data

M. F.

C9H14N2

Suppliers	Catalog Number
Enamine	EN300-115105

Database	Data ID
PubChem	71756913

M. W.

150.22086

CAS

Similarity

N/A

ID: 241959

2-chloro-2-methylpropanenitrile

$$$$ Data

M. F.

C4H6ClN

Suppliers	Catalog Number
Enamine	EN300-115106

Database	Data ID
PubChem	76849

M. W.

103.55014

CAS

Similarity

N/A

ID: 241960

[2-(dimethylamino)ethyl](propan-2-yl)amine

$$$$ Data

M. F.

C7H18N2

Suppliers	Catalog Number
Enamine	EN300-115107

Database	Data ID
PubChem	16770553

M. W.

130.23122

CAS

Similarity

N/A

ID: 241961

3,4-dipropoxybenzoic acid

$$$$ Data

M. F.

C13H18O4

Suppliers	Catalog Number
Enamine	EN300-11511

Database	Data ID
PubChem	2442976

M. W.

238.27962

CAS

Similarity

N/A

ID: 241962

[1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methanamine

$$$$ Data

M. F.

C6H8F3N3

Suppliers	Catalog Number
Enamine	EN300-115129

Database	Data ID
PubChem	53487050

M. W.

179.1430296

CAS

Similarity

N/A

ID: 241963

butyl 4-chlorobenzoate

$$$$ Data

M. F.

C11H13ClO2

Suppliers	Catalog Number
Enamine	EN300-115130

Database	Data ID
PubChem	347849

M. W.

212.67272

CAS

Similarity

N/A

ID: 241964

methyl({[1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl})amine hydrochlorid...

$$$$ Data

M. F.

C7H11ClF3N3

Suppliers	Catalog Number
Enamine	EN300-115131

Database	Data ID
PubChem	71756914

M. W.

229.6305496

CAS

Similarity

N/A

ID: 241965

2-amino-N-benzyl-N-ethylbutanamide

$$$$ Data

M. F.

C13H20N2O

Suppliers	Catalog Number
Enamine	EN300-115132

Database	Data ID
PubChem	19963910

M. W.

220.3107

CAS

Similarity

N/A

ID: 241966

3-amino-N-(thiophen-2-ylmethyl)benzamide

$$$$ Data

M. F.

C12H12N2OS

Suppliers	Catalog Number
Enamine	EN300-115133

Database	Data ID
PubChem	43173648

M. W.

232.30148

CAS

Similarity

N/A

ID: 241967

2-amino-N-cyclohexyl-N-methylbutanamide

$$$$ Data

M. F.

C11H22N2O

Suppliers	Catalog Number
Enamine	EN300-115134

Database	Data ID
PubChem	43649415

M. W.

198.30518

CAS

Similarity

N/A

ID: 241968

propyl 4-chlorobenzoate

$$$$ Data

M. F.

C10H11ClO2

Suppliers	Catalog Number
Enamine	EN300-115135

Database	Data ID
PubChem	347840

M. W.

198.64614

CAS

Similarity

N/A

ID: 241969

2-amino-N-[(2-fluorophenyl)methyl]-N-methylbutanamide

$$$$ Data

M. F.

C12H17FN2O

Suppliers	Catalog Number
Enamine	EN300-115136

Database	Data ID
PubChem	43649648

M. W.

224.2745832

CAS

Similarity

N/A

ID: 241970

methyl 3-(2-phenoxypropanamido)propanoate

$$$$ Data

M. F.

C13H17NO4

Suppliers	Catalog Number
Enamine	EN300-115137

Database	Data ID
PubChem	47101358

M. W.

251.27838

CAS

Similarity

N/A

ID: 241971

propan-2-yl 4-chlorobenzoate

$$$$ Data

M. F.

C10H11ClO2

Suppliers	Catalog Number
Enamine	EN300-115138

Database	Data ID
PubChem	523824

M. W.

198.64614

CAS

Similarity

N/A

ID: 241972

2-amino-N-[1-(thiophen-2-yl)ethyl]butanamide

$$$$ Data

M. F.

C10H16N2OS

Suppliers	Catalog Number
Enamine	EN300-115139

Database	Data ID
PubChem	43649617

M. W.

212.31184

CAS

Similarity

N/A

ID: 241973

2-(4-nitrobenzenesulfonyl)acetic acid

$$$$ Data

M. F.

C8H7NO6S

Suppliers	Catalog Number
Enamine	EN300-11514

Database	Data ID
PubChem	2367267

M. W.

245.20928

CAS

3937-94-8

Similarity

N/A

ID: 241974

3-(2-methylpyrrolidine-1-carbonyl)naphthalen-2-amine

$$$$ Data

M. F.

C16H18N2O

Suppliers	Catalog Number
Enamine	EN300-115140

Database	Data ID
PubChem	61213144

M. W.

254.32692

CAS

Similarity

N/A

ID: 241975

2-amino-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-2-phenylacetamide

$$$$ Data

M. F.

C14H17N3O2

Suppliers	Catalog Number
Enamine	EN300-115142

Database	Data ID
PubChem	43588861

M. W.

259.30368

CAS

Similarity

N/A

ID: 241976

1-(bromomethyl)-3-(2-phenylethoxy)benzene

$$$$ Data

M. F.

C15H15BrO

Suppliers	Catalog Number
Enamine	EN300-115143

Database	Data ID
PubChem	43141722

M. W.

291.183

CAS

Similarity

N/A

ID: 241977

2-[2-(methoxymethyl)-1,3-thiazol-4-yl]acetic acid

$$$$ Data

M. F.

C7H9NO3S

Suppliers	Catalog Number
Enamine	EN300-115145

Database	Data ID
PubChem	61553303

M. W.

187.21626

CAS

Similarity

N/A

ID: 241978

[2-(2-methylpropyl)-1,3-thiazol-5-yl]methanamine

$$$$ Data

M. F.

C8H14N2S

Suppliers	Catalog Number
Enamine	EN300-115146

Database	Data ID
PubChem	57487274

M. W.

170.27516

CAS

Similarity

N/A

ID: 241979

4-{[4-(cyclopropylmethyl)piperazin-1-yl]methyl}-1,3-thiazol-2-amine

$$$$ Data

M. F.

C12H20N4S

Suppliers	Catalog Number
Enamine	EN300-115147

Database	Data ID
PubChem	61441489

M. W.

252.379

CAS

Similarity

N/A

ID: 241980

5-methyl-1-(3-methylbutyl)-1H-pyrazole-4-carboxylic acid

$$$$ Data

M. F.

C10H16N2O2

Suppliers	Catalog Number
Enamine	EN300-115148

Database	Data ID
PubChem	61414487

M. W.

196.24624

CAS

Similarity

N/A

ID: 241981

6-bromo-3-(3-ethoxypropyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one

$$$$ Data

M. F.

C13H15BrN2O2S

Suppliers	Catalog Number
Enamine	EN300-11515

Database	Data ID
PubChem	2446571

M. W.

343.2394

CAS

Similarity

N/A

ID: 241982

2-fluorocyclopentan-1-amine hydrochloride

$$$$ Data

M. F.

C5H11ClFN

Suppliers	Catalog Number
Enamine	EN300-115151

Database	Data ID
PubChem	22715766

M. W.

139.5989432

CAS

Similarity

N/A

ID: 241983

2-chloro-6-(morpholin-4-yl)pyridine-4-carboxylic acid

$$$$ Data

M. F.

C10H11ClN2O3

Suppliers	Catalog Number
Enamine	EN300-115152

Database	Data ID
PubChem	21430341

M. W.

242.65894

CAS

Similarity

N/A

ID: 241984

2-cyclopropyl-2-hydroxypropanenitrile

$$$$ Data

M. F.

C6H9NO

Suppliers	Catalog Number
Enamine	EN300-115153

Database	Data ID
PubChem	43436603

M. W.

111.14176

CAS

Similarity

N/A

ID: 241985

4-chloro-3,4-dihydro-2H-1-benzothiopyran

$$$$ Data

M. F.

C9H9ClS

Suppliers	Catalog Number
Enamine	EN300-115154

Database	Data ID
PubChem	11063100

M. W.

184.68576

CAS

Similarity

N/A

ID: 241986

4-cyano-2-methylbenzoic acid

$$$$ Data

M. F.

C9H7NO2

Suppliers	Catalog Number
Enamine	EN300-115156

Database	Data ID
PubChem	11819339

M. W.

161.15738

CAS

Similarity

N/A

ID: 241987

methyl 4-ethyl-1,3-thiazole-5-carboxylate

$$$$ Data

M. F.

C7H9NO2S

Suppliers	Catalog Number
Enamine	EN300-115157

Database	Data ID
PubChem	19902848

M. W.

171.21686

CAS

Similarity

N/A

ID: 241988

5-fluoro-6-nitro-2,3-dihydro-1,3-benzoxazol-2-one

$$$$ Data

M. F.

C7H3FN2O4

Suppliers	Catalog Number
Enamine	EN300-115158

Database	Data ID
PubChem	11217835

M. W.

198.1081232

CAS

Similarity

N/A

ID: 241989

3,3-dimethyl-7-oxabicyclo[4.1.0]heptane

$$$$ Data

M. F.

C8H14O

Suppliers	Catalog Number
Enamine	EN300-115159

Database	Data ID
PubChem	54351962

M. W.

126.19616

CAS

Similarity

N/A

ID: 241990

6-bromo-3-(2-methylpropyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one

$$$$ Data

M. F.

C12H13BrN2OS

Suppliers	Catalog Number
Enamine	EN300-11516

Database	Data ID
PubChem	2446569

M. W.

313.21342

CAS

Similarity

N/A

ID: 241991

tert-butyl N-(3-amino-2-methylpropyl)carbamate

$$$$ Data

M. F.

C9H20N2O2

Suppliers	Catalog Number
Enamine	EN300-115160

Database	Data ID
PubChem	44629801

M. W.

188.2673

CAS

Similarity

N/A

ID: 241992

tert-butyl 2-[(butan-2-yl)amino]acetate

$$$$ Data

M. F.

C10H21NO2

Suppliers	Catalog Number
Enamine	EN300-115161

Database	Data ID
PubChem	54042543

M. W.

187.27924

CAS

Similarity

N/A

ID: 241993

2-cyano-3-methylbenzene-1-sulfonyl chloride

$$$$ Data

M. F.

C8H6ClNO2S

Suppliers	Catalog Number
Enamine	EN300-115165

Database	Data ID
PubChem	50901558

M. W.

215.65674

CAS

Similarity

N/A

ID: 241994

2-(4-nitro-1H-pyrazol-1-yl)quinoxaline

$$$$ Data

M. F.

C11H7N5O2

Suppliers	Catalog Number
Enamine	EN300-115168

Database	Data ID
PubChem	71756916

M. W.

241.20558

CAS

Similarity

N/A

ID: 241995

(1S)-1-(pyridin-4-yl)ethan-1-amine dihydrochloride

$$$$ Data

M. F.

C7H12Cl2N2

Suppliers	Catalog Number
Enamine	EN300-115170

Database	Data ID
PubChem	69779592

M. W.

195.08958

CAS

Similarity

N/A

ID: 241996

1-(oxan-4-yl)-1H-pyrazole-4-sulfonyl chloride

$$$$ Data

M. F.

C8H11ClN2O3S

Suppliers	Catalog Number
Enamine	EN300-115173

Database	Data ID
PubChem	63936713

M. W.

250.70254

CAS

Similarity

N/A

ID: 241997

1-cyclopropyl-decahydro-1,6-naphthyridin-2-one dihydrochloride

$$$$ Data

M. F.

C11H20Cl2N2O

Suppliers	Catalog Number
Enamine	EN300-115176

Database	Data ID
PubChem	71756917

M. W.

267.1953

CAS

Similarity

N/A

ID: 241998

(3R,4S)-piperidine-3,4-diol hydrochloride

$$$$ Data

M. F.

C5H12ClNO2

Suppliers	Catalog Number
Enamine	EN300-115182

Database	Data ID
PubChem	10241001

M. W.

153.60728

CAS

Similarity

N/A

ID: 241999

N-(2-methoxyphenyl)-2-(piperazin-1-yl)acetamide hydrochloride

$$$$ Data

M. F.

C13H20ClN3O2

Suppliers	Catalog Number
Enamine	EN300-115188

Database	Data ID
PubChem	71692609

M. W.

285.7698

CAS

Similarity

N/A

ID: 242000

2-[(1,3-thiazol-4-ylmethyl)sulfanyl]acetic acid

$$$$ Data

M. F.

C6H7NO2S2

Suppliers	Catalog Number
Enamine	EN300-115195

Database	Data ID
PubChem	28781993

M. W.

189.25528

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