Chembase list of 866358 unique molecular structures

2-chloro-5-(1,2,3,6-tetrahydropyridin-4-yl)pyridine hydrochloride

$$$$ Data

M. F.

C10H12Cl2N2

Suppliers	Catalog Number
Enamine	EN300-124360

Database	Data ID
PubChem	71757853

M. W.

231.12168

CAS

Similarity

N/A

ID: 246002

2H,3H-1λ⁶,2,7-[1λ⁶,2]thiazolo[5,4-b]pyridine-1,1,3-trion...

$$$$ Data

M. F.

C6H4N2O3S

Suppliers	Catalog Number
Enamine	EN300-124361

Database	Data ID
PubChem	15044432

M. W.

184.17256

CAS

Similarity

N/A

ID: 246003

5-bromo-7-methyl-1-benzofuran-2-carboxylic acid

$$$$ Data

M. F.

C10H7BrO3

Suppliers	Catalog Number
Enamine	EN300-124362

Database	Data ID
PubChem	63216788

M. W.

255.06478

CAS

Similarity

N/A

ID: 246004

(3-fluoro-5-methoxyphenyl)methanamine

$$$$ Data

M. F.

C8H10FNO

Suppliers	Catalog Number
Enamine	EN300-124363

Database	Data ID
PubChem	24721203

M. W.

155.1695032

CAS

Similarity

N/A

ID: 246005

4-bromo-1-[(tert-butoxy)carbonyl]piperidine-4-carboxylic acid

$$$$ Data

M. F.

C11H18BrNO4

Suppliers	Catalog Number
Enamine	EN300-124364

Database	Data ID
PubChem	25271414

M. W.

308.16892

CAS

Similarity

N/A

ID: 246006

1-(morpholin-4-yl)cyclobutane-1-carboxylic acid

$$$$ Data

M. F.

C9H15NO3

Suppliers	Catalog Number
Enamine	EN300-124365

Database	Data ID
PubChem	62389657

M. W.

185.2203

CAS

Similarity

N/A

ID: 246007

3-tert-butyl-1-methyl-1H-pyrazole-4-carbaldehyde

$$$$ Data

M. F.

C9H14N2O

Suppliers	Catalog Number
Enamine	EN300-124366

Database	Data ID
PubChem	43141282

M. W.

166.22026

CAS

Similarity

N/A

ID: 246008

3-tert-butyl-1-methyl-1H-pyrazole-4-carboxylic acid

$$$$ Data

M. F.

C9H14N2O2

Suppliers	Catalog Number
Enamine	EN300-124367

Database	Data ID
PubChem	33782562

M. W.

182.21966

CAS

Similarity

N/A

ID: 246009

1-methyl-3-(thiophen-2-yl)-1H-pyrazole-4-carboxylic acid

$$$$ Data

M. F.

C9H8N2O2S

Suppliers	Catalog Number
Enamine	EN300-124368

Database	Data ID
PubChem	42281966

M. W.

208.23702

CAS

Similarity

N/A

ID: 246010

1-methyl-3-(thiophen-2-yl)-1H-pyrazole-4-carbaldehyde

$$$$ Data

M. F.

C9H8N2OS

Suppliers	Catalog Number
Enamine	EN300-124369

Database	Data ID
PubChem	39095814

M. W.

192.23762

CAS

Similarity

N/A

ID: 246011

tetracyclo[6.6.2.0²,⁷.0⁹,¹⁴

$$$$ Data

M. F.

C17H17N

Suppliers	Catalog Number
Enamine	EN300-12437

Database	Data ID
PubChem	411838

M. W.

235.32358

CAS

4053-27-4

Similarity

N/A

ID: 246012

[6-(2,2-difluoroethoxy)pyridin-2-yl]methanamine

$$$$ Data

M. F.

C8H10F2N2O

Suppliers	Catalog Number
Enamine	EN300-124370

Database	Data ID
PubChem	71757854

M. W.

188.1746064

CAS

Similarity

N/A

ID: 246013

1-(1-methyl-1H-pyrazol-4-yl)propan-2-one

$$$$ Data

M. F.

C7H10N2O

Suppliers	Catalog Number
Enamine	EN300-124371

Database	Data ID
PubChem	62126421

M. W.

138.1671

CAS

Similarity

N/A

ID: 246014

2-(2,2,2-trifluoroethyl)-1,2,3,4-tetrahydroisoquinolin-5-amine

$$$$ Data

M. F.

C11H13F3N2

Suppliers	Catalog Number
Enamine	EN300-124373

Database	Data ID
PubChem	61014391

M. W.

230.2295296

CAS

Similarity

N/A

ID: 246015

5-sulfamoylpyridine-2-carboxylic acid

$$$$ Data

M. F.

C6H6N2O4S

Suppliers	Catalog Number
Enamine	EN300-124374

Database	Data ID
PubChem	57336589

M. W.

202.18784

CAS

Similarity

N/A

ID: 246016

4-(2,5-dihydro-1H-pyrrol-3-yl)-N,N-dimethylaniline

$$$$ Data

M. F.

C12H16N2

Suppliers	Catalog Number
Enamine	EN300-124375

Database	Data ID
PubChem	16005222

M. W.

188.26884

CAS

Similarity

N/A

ID: 246017

(2S)-3-(methylamino)propane-1,2-diol

$$$$ Data

M. F.

C4H11NO2

Suppliers	Catalog Number
Enamine	EN300-124376

Database	Data ID
PubChem	7021473

M. W.

105.13564

CAS

Similarity

N/A

ID: 246018

(1R,2R)-cycloheptane-1,2-diamine dihydrochloride

$$$$ Data

M. F.

C7H18Cl2N2

Suppliers	Catalog Number
Enamine	EN300-124377

Database	Data ID
PubChem	71757855

M. W.

201.13722

CAS

Similarity

N/A

ID: 246019

1-(4-fluorophenyl)-1-methoxypropan-2-amine hydrochloride

$$$$ Data

M. F.

C10H15ClFNO

Suppliers	Catalog Number
Enamine	EN300-124379

Database	Data ID
PubChem	3046421

M. W.

219.6836032

CAS

Similarity

N/A

ID: 246020

5-(chloromethyl)-3-cyclopropyl-1H-1,2,4-triazole hydrochloride

$$$$ Data

M. F.

C6H9Cl2N3

Suppliers	Catalog Number
Enamine	EN300-124380

Database	Data ID
PubChem	71757856

M. W.

194.06176

CAS

Similarity

N/A

ID: 246021

2-cyclopropyl-2-(methylamino)propanenitrile

$$$$ Data

M. F.

C7H12N2

Suppliers	Catalog Number
Enamine	EN300-124381

Database	Data ID
PubChem	43114993

M. W.

124.18358

CAS

Similarity

N/A

ID: 246022

tert-butyl N-(4-oxopentan-2-yl)carbamate

$$$$ Data

M. F.

C10H19NO3

Suppliers	Catalog Number
Enamine	EN300-124382

Database	Data ID
PubChem	45091969

M. W.

201.26276

CAS

Similarity

N/A

ID: 246023

morpholine-3-carboxamide

$$$$ Data

M. F.

C5H10N2O2

Suppliers	Catalog Number
Enamine	EN300-124383

Database	Data ID
PubChem	19792002

M. W.

130.1451

CAS

Similarity

N/A

ID: 246024

4-hydroxy-1-methyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid

$$$$ Data

M. F.

C8H7N3O3

Suppliers	Catalog Number
Enamine	EN300-124384

Database	Data ID
PubChem	2755837

M. W.

193.15948

CAS

Similarity

N/A

ID: 246025

3-{[(dimethyl-1,2-oxazol-4-yl)methyl](methyl)amino}propanoic acid hydrochloride

$$$$ Data

M. F.

C10H17ClN2O3

Suppliers	Catalog Number
Enamine	EN300-124386

Database	Data ID
PubChem	71757858

M. W.

248.70658

CAS

Similarity

N/A

ID: 246026

3-methoxypyrazine-2-carbaldehyde

$$$$ Data

M. F.

C6H6N2O2

Suppliers	Catalog Number
Enamine	EN300-124387
A&J Pharmtech	AJA-O21446

Database	Data ID
PubChem	15880597

M. W.

138.12404

CAS

63874-90-8

Similarity

N/A

ID: 246027

1-(3-aminopropyl)-3-methyl-1,2-dihydroquinoxalin-2-one dihydrochloride

$$$$ Data

M. F.

C12H17Cl2N3O

Suppliers	Catalog Number
Enamine	EN300-124390

Database	Data ID
PubChem	71757859

M. W.

290.18888

CAS

Similarity

N/A

ID: 246028

6-fluoro-1,3-dimethyl-1,2,3,4-tetrahydroisoquinoline hydrochloride

$$$$ Data

M. F.

C11H15ClFN

Suppliers	Catalog Number
Enamine	EN300-124393

Database	Data ID
PubChem	71757860

M. W.

215.6949032

CAS

Similarity

N/A

ID: 246029

1-(oxetan-3-yl)piperazine; bis(trifluoroacetic acid)

$$$$ Data

M. F.

C11H16F6N2O5

Suppliers	Catalog Number
Enamine	EN300-124394

Database	Data ID
PubChem	71757861

M. W.

370.2455592

CAS

Similarity

N/A

ID: 246030

1-(aminomethyl)-7-methoxy-1,2,3,4-tetrahydronaphthalen-1-ol hydrochloride

$$$$ Data

M. F.

C12H18ClNO2

Suppliers	Catalog Number
Enamine	EN300-124400

Database	Data ID
PubChem	71757862

M. W.

243.72982

CAS

Similarity

N/A

ID: 246031

ethyl 5-amino-4-benzoyl-3-methylthiophene-2-carboxylate

$$$$ Data

M. F.

C15H15NO3S

Suppliers	Catalog Number
Enamine	EN300-124412

Database	Data ID
PubChem	12394686

M. W.

289.3495

CAS

Similarity

N/A

ID: 246032

3-bromoimidazo[1,2-a]pyrazine-8-carboxylic acid

$$$$ Data

M. F.

C7H4BrN3O2

Suppliers	Catalog Number
Enamine	EN300-124413

Database	Data ID
PubChem	65810693

M. W.

242.02956

CAS

Similarity

N/A

ID: 246033

2-phenylpentanal

$$$$ Data

M. F.

C11H14O

Suppliers	Catalog Number
Enamine	EN300-124415

Database	Data ID
PubChem	14715228

M. W.

162.22826

CAS

Similarity

N/A

ID: 246034

7-bromo-1-chloro-1,2,3,4-tetrahydronaphthalene

$$$$ Data

M. F.

C10H10BrCl

Suppliers	Catalog Number
Enamine	EN300-124417

Database	Data ID
PubChem	62737506

M. W.

245.5434

CAS

Similarity

N/A

ID: 246035

ethyl 2-isocyanato-2-methylpropanoate

$$$$ Data

M. F.

C7H11NO3

Suppliers	Catalog Number
Enamine	EN300-124418

Database	Data ID
PubChem	21709191

M. W.

157.16714

CAS

Similarity

N/A

ID: 246036

2-chloro-N-(1-cyano-1-methylethyl)-N-cyclopropylacetamide

$$$$ Data

M. F.

C9H13ClN2O

Suppliers	Catalog Number
Enamine	EN300-12442

Database	Data ID
PubChem	4961896

M. W.

200.66532

CAS

Similarity

N/A

ID: 246037

methyl 4-chloro-5-ethyl-1H-pyrazole-3-carboxylate

$$$$ Data

M. F.

C7H9ClN2O2

Suppliers	Catalog Number
Enamine	EN300-124420

Database	Data ID
PubChem	61795855

M. W.

188.61156

CAS

Similarity

N/A

ID: 246038

(4,4-dimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanamine

$$$$ Data

M. F.

C13H19N

Suppliers	Catalog Number
Enamine	EN300-124421

Database	Data ID
PubChem	43316841

M. W.

189.29666

CAS

Similarity

N/A

ID: 246039

1,2-dimethylcyclopropan-1-ol

$$$$ Data

M. F.

C5H10O

Suppliers	Catalog Number
Enamine	EN300-124422

Database	Data ID
PubChem	14453682

M. W.

86.1323

CAS

Similarity

N/A

ID: 246040

1-ethyl-2-methyl-1H-imidazole-4-sulfonamide

$$$$ Data

M. F.

C6H11N3O2S

Suppliers	Catalog Number
Enamine	EN300-124423

Database	Data ID
PubChem	62065334

M. W.

189.23544

CAS

Similarity

N/A

ID: 246041

ethyl 1-benzothiophene-3-carboxylate

$$$$ Data

M. F.

C11H10O2S

Suppliers	Catalog Number
Enamine	EN300-124424

Database	Data ID
PubChem	898679

M. W.

206.2609

CAS

Similarity

N/A

ID: 246042

2-(2-aminoethoxy)-4-chloropyridine

$$$$ Data

M. F.

C7H9ClN2O

Suppliers	Catalog Number
Enamine	EN300-124427
A&J Pharmtech	AJA-O6684

Database	Data ID
PubChem	71302213

M. W.

172.61216

CAS

1346708-15-3

Similarity

N/A

ID: 246043

methyl 4-hydroxypiperidine-4-carboxylate hydrochloride

$$$$ Data

M. F.

C7H14ClNO3

Suppliers	Catalog Number
Enamine	EN300-124430

Database	Data ID
PubChem	53399175

M. W.

195.64396

CAS

Similarity

N/A

ID: 246044

ethyl 5-bromo-2,3-dihydro-1-benzofuran-3-carboxylate

$$$$ Data

M. F.

C11H11BrO3

Suppliers	Catalog Number
Enamine	EN300-124431

Database	Data ID
PubChem	13621276

M. W.

271.10724

CAS

Similarity

N/A

ID: 246045

3-amino-5-fluoro-2-methylbenzoic acid hydrochloride

$$$$ Data

M. F.

C8H9ClFNO2

Suppliers	Catalog Number
Enamine	EN300-124432

Database	Data ID
PubChem	71757863

M. W.

205.6139632

CAS

Similarity

N/A

ID: 246046

4-(methylsulfanyl)-6-(trifluoromethyl)-1,3,5-triazin-2-amine

$$$$ Data

M. F.

C5H5F3N4S

Suppliers	Catalog Number
Enamine	EN300-124433

Database	Data ID
PubChem	22244968

M. W.

210.1802096

CAS

Similarity

N/A

ID: 246047

3-methyl-1H-indazol-6-amine

$$$$ Data

M. F.

C8H9N3

Suppliers	Catalog Number
Enamine	EN300-124435

Database	Data ID
PubChem	21956337

M. W.

147.17716

CAS

Similarity

N/A

ID: 246048

2,6-dimethyloxane-4-carboxylic acid

$$$$ Data

M. F.

C8H14O3

Suppliers	Catalog Number
Enamine	EN300-124436

Database	Data ID
PubChem	69262009

M. W.

158.19496

CAS

Similarity

N/A

ID: 246049

3-(4-methoxyphenyl)-2,5-dihydro-1H-pyrrole

$$$$ Data

M. F.

C11H13NO

Suppliers	Catalog Number
Enamine	EN300-124437

Database	Data ID
PubChem	16005226

M. W.

175.22702

CAS

Similarity

N/A

ID: 246050

5-methoxy-1H-1,2,4-triazol-3-amine

$$$$ Data

M. F.

C3H6N4O

Suppliers	Catalog Number
Enamine	EN300-124438

Database	Data ID
PubChem	307982

M. W.

114.10594

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