Chembase list of 866358 unique molecular structures

(4-bromo-2-fluorophenyl)(phenyl)methanone

$$$$ Data

M. F.

C13H8BrFO

Suppliers	Catalog Number
Enamine	EN300-43167

Database	Data ID
PubChem	11150151

M. W.

279.1044232

CAS

Similarity

N/A

ID: 259352

[6-(cyclopentyloxy)pyridin-3-yl]methanamine

$$$$ Data

M. F.

C11H16N2O

Suppliers	Catalog Number
Enamine	EN300-43168

Database	Data ID
PubChem	16783901

M. W.

192.25754

CAS

Similarity

N/A

ID: 259353

1-(butane-1-sulfonyl)pyrrolidine-2-carboxylic acid

$$$$ Data

M. F.

C9H17NO4S

Suppliers	Catalog Number
Enamine	EN300-43169

Database	Data ID
PubChem	16228453

M. W.

235.30058

CAS

Similarity

N/A

ID: 259354

[6-(4-methyl-1,4-diazepan-1-yl)pyridin-3-yl]methanamine

$$$$ Data

M. F.

C12H20N4

Suppliers	Catalog Number
Enamine	EN300-43170

Database	Data ID
PubChem	28744777

M. W.

220.314

CAS

Similarity

N/A

ID: 259355

1-(4-butoxy-3-methoxyphenyl)ethan-1-amine hydrochloride

$$$$ Data

M. F.

C13H22ClNO2

Suppliers	Catalog Number
Enamine	EN300-43171

Database	Data ID
PubChem	42941941

M. W.

259.77228

CAS

Similarity

N/A

ID: 259356

1-(4-butoxy-3-methoxyphenyl)ethan-1-one

$$$$ Data

M. F.

C13H18O3

Suppliers	Catalog Number
Enamine	EN300-43172

Database	Data ID
PubChem	24702577

M. W.

222.28022

CAS

Similarity

N/A

ID: 259357

2-(4-ethylpiperazin-1-yl)benzaldehyde

$$$$ Data

M. F.

C13H18N2O

Suppliers	Catalog Number
Enamine	EN300-43173

Database	Data ID
PubChem	40428517

M. W.

218.29482

CAS

865203-79-8

Similarity

N/A

ID: 259358

2-[methyl(1-methylpiperidin-4-yl)amino]benzaldehyde

$$$$ Data

M. F.

C14H20N2O

Suppliers	Catalog Number
Enamine	EN300-43174

Database	Data ID
PubChem	28603713

M. W.

232.3214

CAS

Similarity

N/A

ID: 259359

3-amino-N-(3-ethoxypropyl)benzamide

$$$$ Data

M. F.

C12H18N2O2

Suppliers	Catalog Number
Enamine	EN300-43175

Database	Data ID
PubChem	16795870

M. W.

222.28352

CAS

Similarity

N/A

ID: 259360

N-benzyl(dodecylsulfanyl)methanimidamide hydrobromide

$$$$ Data

M. F.

C20H35BrN2S

Suppliers	Catalog Number
Enamine	EN300-43180

Database	Data ID
PubChem	42962652

M. W.

415.4743

CAS

Similarity

N/A

ID: 259361

N-[2-(4-methoxyphenyl)ethyl](dodecylsulfanyl)methanimidamide hydrobromide

$$$$ Data

M. F.

C22H39BrN2OS

Suppliers	Catalog Number
Enamine	EN300-43181

Database	Data ID
PubChem	45791416

M. W.

459.52686

CAS

Similarity

N/A

ID: 259362

N-phenyl(dodecylsulfanyl)methanimidamide hydrobromide

$$$$ Data

M. F.

C19H33BrN2S

Suppliers	Catalog Number
Enamine	EN300-43183

Database	Data ID
PubChem	42962654

M. W.

401.44772

CAS

Similarity

N/A

ID: 259363

(dodecylsulfanyl)methanimidamide hydrobromide

$$$$ Data

M. F.

C13H29BrN2S

Suppliers	Catalog Number
Enamine	EN300-43185

Database	Data ID
PubChem	77086

M. W.

325.35176

CAS

Similarity

N/A

ID: 259364

N-cyclopentyl(dodecylsulfanyl)methanimidamide hydrobromide

$$$$ Data

M. F.

C18H37BrN2S

Suppliers	Catalog Number
Enamine	EN300-43187

Database	Data ID
PubChem	45791418

M. W.

393.46878

CAS

Similarity

N/A

ID: 259365

3-amino-N,4-dimethyl-N-(propan-2-yl)benzene-1-sulfonamide

$$$$ Data

M. F.

C11H18N2O2S

Suppliers	Catalog Number
Enamine	EN300-43188

Database	Data ID
PubChem	29564654

M. W.

242.33782

CAS

Similarity

N/A

ID: 259366

4-amino-N-[(2Z)-1-methylpyrrolidin-2-ylidene]benzene-1-sulfonamide

$$$$ Data

M. F.

C11H15N3O2S

Suppliers	Catalog Number
Enamine	EN300-43189

Database	Data ID
PubChem	6510231

M. W.

253.3207

CAS

Similarity

N/A

ID: 259367

3-amino-4-fluorobenzene-1-sulfonamide

$$$$ Data

M. F.

C6H7FN2O2S

Suppliers	Catalog Number
Enamine	EN300-43190

Database	Data ID
PubChem	24270636

M. W.

190.1953832

CAS

Similarity

N/A

ID: 259368

3-{[2-(propan-2-yl)-1H-imidazol-1-yl]methyl}aniline

$$$$ Data

M. F.

C13H17N3

Suppliers	Catalog Number
ChemBridge	3005409
Enamine	EN300-43191

Database	Data ID
PubChem	42951959

M. W.

215.29418

CAS

1021062-16-7

Similarity

N/A

ID: 259369

3-{[(4-bromophenyl)carbamoyl]amino}propanoic acid

$$$$ Data

M. F.

C10H11BrN2O3

Suppliers	Catalog Number
Enamine	EN300-43192

Database	Data ID
PubChem	18072916

M. W.

287.10994

CAS

Similarity

N/A

ID: 259370

2-[4-(1-aminoethyl)phenoxy]-N-cyclopropylacetamide

$$$$ Data

M. F.

C13H18N2O2

Suppliers	Catalog Number
Enamine	EN300-43193

Database	Data ID
PubChem	16783067

M. W.

234.29422

CAS

Similarity

N/A

ID: 259371

ethyl 1-aminocyclohexane-1-carboxylate hydrochloride

$$$$ Data

M. F.

C9H18ClNO2

Suppliers	Catalog Number
Enamine	EN300-43194

Database	Data ID
PubChem	11241228

M. W.

207.69772

CAS

63203-48-5

Similarity

N/A

ID: 259372

3-[(cyclopropylamino)methyl]phenol

$$$$ Data

M. F.

C10H13NO

Suppliers	Catalog Number
Enamine	EN300-43195

Database	Data ID
PubChem	16784379

M. W.

163.21632

CAS

Similarity

N/A

ID: 259373

3-{[(4-chlorophenyl)methyl]amino}propanoic acid hydrochloride

$$$$ Data

M. F.

C10H13Cl2NO2

Suppliers	Catalog Number
Enamine	EN300-43196

Database	Data ID
PubChem	42916911

M. W.

250.12172

CAS

Similarity

N/A

ID: 259374

(3-chlorophenyl)(phenyl)methanamine hydrochloride

$$$$ Data

M. F.

C13H13Cl2N

Suppliers	Catalog Number
Enamine	EN300-43197

Database	Data ID
PubChem	21528812

M. W.

254.15502

CAS

5267-37-8

Similarity

N/A

ID: 259375

N,4-dimethyl-1,3-thiazol-2-amine

$$$$ Data

M. F.

C5H8N2S

Suppliers	Catalog Number
Enamine	EN300-43198
A&J Pharmtech	AJA-O35507

Database	Data ID
PubChem	817030

M. W.

128.19542

CAS

2161-68-4

Similarity

N/A

ID: 259376

1-[(2-chlorophenyl)methyl]piperidin-4-one

$$$$ Data

M. F.

C12H14ClNO

Suppliers	Catalog Number
Enamine	EN300-43199

Database	Data ID
PubChem	11959531

M. W.

223.69866

CAS

Similarity

N/A

ID: 259377

2-(3-chlorophenyl)-2H-1,2,3-triazole-4-carbaldehyde

$$$$ Data

M. F.

C9H6ClN3O

Suppliers	Catalog Number
Enamine	EN300-43200

Database	Data ID
PubChem	12461588

M. W.

207.61644

CAS

Similarity

N/A

ID: 259378

N-(5-chloro-2-hydroxyphenyl)piperidine-4-carboxamide

$$$$ Data

M. F.

C12H15ClN2O2

Suppliers	Catalog Number
Enamine	EN300-43203

Database	Data ID
PubChem	39869080

M. W.

254.7127

CAS

Similarity

N/A

ID: 259379

3-oxo-N-(2-phenylethyl)butanamide

$$$$ Data

M. F.

C12H15NO2

Suppliers	Catalog Number
Enamine	EN300-43205

Database	Data ID
PubChem	360022

M. W.

205.253

CAS

Similarity

N/A

ID: 259380

2-(1,1-dioxo-1λ⁶,2-thiazolidin-2-yl)acetic acid

$$$$ Data

M. F.

C5H9NO4S

Suppliers	Catalog Number
Enamine	EN300-43206

Database	Data ID
PubChem	14668522

M. W.

179.19426

CAS

Similarity

N/A

ID: 259381

3,5-dimethyl-1-(piperidin-4-yl)piperidine dihydrochloride

$$$$ Data

M. F.

C12H26Cl2N2

Suppliers	Catalog Number
Enamine	EN300-43207

Database	Data ID
PubChem	42948938

M. W.

269.25424

CAS

Similarity

N/A

ID: 259382

2-methyl-4-(piperidin-4-yl)morpholine dihydrochloride

$$$$ Data

M. F.

C10H22Cl2N2O

Suppliers	Catalog Number
Enamine	EN300-43208

Database	Data ID
PubChem	42948940

M. W.

257.20048

CAS

Similarity

N/A

ID: 259383

1-amino-N-ethylcyclohexane-1-carboxamide hydrochloride

$$$$ Data

M. F.

C9H19ClN2O

Suppliers	Catalog Number
Enamine	EN300-43209

Database	Data ID
PubChem	42948598

M. W.

206.71296

CAS

Similarity

N/A

ID: 259384

N-[(2-chlorophenyl)methyl]-N-methyl-3-oxobutanamide

$$$$ Data

M. F.

C12H14ClNO2

Suppliers	Catalog Number
Enamine	EN300-43210

Database	Data ID
PubChem	12131481

M. W.

239.69806

CAS

Similarity

N/A

ID: 259385

[6-(2-methyl-1H-imidazol-1-yl)pyridin-3-yl]methanamine

$$$$ Data

M. F.

C10H12N4

Suppliers	Catalog Number
Enamine	EN300-43211

Database	Data ID
PubChem	16786119

M. W.

188.22908

CAS

Similarity

N/A

ID: 259386

[6-(3,5-dimethyl-1H-pyrazol-1-yl)pyridin-3-yl]methanamine

$$$$ Data

M. F.

C11H14N4

Suppliers	Catalog Number
Enamine	EN300-43213

Database	Data ID
PubChem	16787591

M. W.

202.25566

CAS

Similarity

N/A

ID: 259387

1-[3-(pyridin-2-ylmethoxy)phenyl]ethan-1-amine

$$$$ Data

M. F.

C14H16N2O

Suppliers	Catalog Number
Enamine	EN300-43215

Database	Data ID
PubChem	16783085

M. W.

228.28964

CAS

Similarity

N/A

ID: 259388

1-(2-aminobenzoyl)piperidin-3-ol

$$$$ Data

M. F.

C12H16N2O2

Suppliers	Catalog Number
Enamine	EN300-43216

Database	Data ID
PubChem	16770198

M. W.

220.26764

CAS

Similarity

N/A

ID: 259389

2-(2,5-dimethoxyphenyl)oxirane

$$$$ Data

M. F.

C10H12O3

Suppliers	Catalog Number
Enamine	EN300-43219

Database	Data ID
PubChem	15933371

M. W.

180.20048

CAS

Similarity

N/A

ID: 259390

[(6-chloropyridin-3-yl)methyl]dimethylamine

$$$$ Data

M. F.

C8H11ClN2

Suppliers	Catalog Number
ChemBridge	5402629
Enamine	EN300-43220

Database	Data ID
PubChem	12056677

M. W.

170.63934

CAS

221146-31-2

Similarity

N/A

ID: 259391

2-(4-methylpiperazine-1-carbonyl)-1,2,3,4-tetrahydroquinoline

$$$$ Data

M. F.

C15H21N3O

Suppliers	Catalog Number
Enamine	EN300-43221

Database	Data ID
PubChem	24697610

M. W.

259.34674

CAS

Similarity

N/A

ID: 259392

4-chloro-1,3-thiazole-5-carboxylic acid

$$$$ Data

M. F.

C4H2ClNO2S

Suppliers	Catalog Number
Enamine	EN300-43224

Database	Data ID
PubChem	22147840

M. W.

163.58218

CAS

444909-59-5

Similarity

N/A

ID: 259393

methyl 2,4-dichloro-1,3-thiazole-5-carboxylate

$$$$ Data

M. F.

C5H3Cl2NO2S

Suppliers	Catalog Number
Enamine	EN300-43225

Database	Data ID
PubChem	24219260

M. W.

212.05382

CAS

861708-66-9

Similarity

N/A

ID: 259394

6-ethyl-2-(pyridin-4-yl)-3,4-dihydropyrimidin-4-one

$$$$ Data

M. F.

C11H11N3O

Suppliers	Catalog Number
Enamine	EN300-43226

Database	Data ID
PubChem	39869081

M. W.

201.22454

CAS

Similarity

N/A

ID: 259395

2-(pyrrolidin-1-yl)ethanethioamide

$$$$ Data

M. F.

C6H12N2S

Suppliers	Catalog Number
Enamine	EN300-43229

Database	Data ID
PubChem	13121968

M. W.

144.23788

CAS

Similarity

N/A

ID: 259396

3-[2-(dimethylamino)ethyl]-2-sulfanyl-3H,4H-thieno[3,2-d]pyrimidin-4-one

$$$$ Data

M. F.

C10H13N3OS2

Suppliers	Catalog Number
Enamine	EN300-43230

Database	Data ID
PubChem	16768103

M. W.

255.35972

CAS

Similarity

N/A

ID: 259397

1-methylcyclohexan-1-amine

$$$$ Data

M. F.

C7H15N

Suppliers	Catalog Number
ChemBridge	4017356
Enamine	EN300-43234

Database	Data ID
PubChem	3021578

M. W.

113.2007

CAS

6526-78-9

Similarity

N/A

ID: 259398

4-(1,3-thiazol-2-yl)aniline dihydrochloride

$$$$ Data

M. F.

C9H10Cl2N2S

Suppliers	Catalog Number
Enamine	EN300-43235

Database	Data ID
PubChem	45791420

M. W.

249.1601

CAS

Similarity

N/A

ID: 259399

N-methylpyrimidin-2-amine

$$$$ Data

M. F.

C5H7N3

Suppliers	Catalog Number
Enamine	EN300-43236
A&J Pharmtech	AJA-O39499

Database	Data ID
PubChem	265776

M. W.

109.12918

CAS

931-61-3

Similarity

N/A

ID: 259400

2,6-dimethyl-4-(piperidin-4-yl)morpholine dihydrochloride

$$$$ Data

M. F.

C11H24Cl2N2O

Suppliers	Catalog Number
Enamine	EN300-43238

Database	Data ID
PubChem	42948939

M. W.

271.22706

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