Chembase list of 866358 unique molecular structures

[3-(dimethylamino)propyl](2-methoxyethyl)amine

$$$$ Data

M. F.

C8H20N2O

Suppliers	Catalog Number
Enamine	EN300-39037

Database	Data ID
PubChem	3019741

M. W.

160.2572

CAS

84176-68-1

Similarity

N/A

ID: 257202

N-cyclohexyl-N-methyl-2-(methylamino)acetamide

$$$$ Data

M. F.

C10H20N2O

Suppliers	Catalog Number
Enamine	EN300-39038

Database	Data ID
PubChem	24708018

M. W.

184.2786

CAS

Similarity

N/A

ID: 257203

1-sulfamoylpiperidine-4-carboxamide

$$$$ Data

M. F.

C6H13N3O3S

Suppliers	Catalog Number
Enamine	EN300-39040

Database	Data ID
PubChem	39869888

M. W.

207.25072

CAS

Similarity

N/A

ID: 257204

(4-ethoxy-3-methoxyphenyl)methanamine

$$$$ Data

M. F.

C10H15NO2

Suppliers	Catalog Number
Enamine	EN300-39041

Database	Data ID
PubChem	7139460

M. W.

181.2316

CAS

93489-14-6

Similarity

N/A

ID: 257205

2-(6-fluoro-2,4-dihydro-1,3-benzodioxin-8-yl)ethan-1-amine

$$$$ Data

M. F.

C10H12FNO2

Suppliers	Catalog Number
Enamine	EN300-39042

Database	Data ID
PubChem	39869892

M. W.

197.2061832

CAS

Similarity

N/A

ID: 257206

2-(quinolin-8-yl)ethan-1-amine hydrochloride

$$$$ Data

M. F.

C11H13ClN2

Suppliers	Catalog Number
Enamine	EN300-39044

Database	Data ID
PubChem	43810688

M. W.

208.68732

CAS

Similarity

N/A

ID: 257207

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

$$$$ Data

M. F.

C9H9N3O

Suppliers	Catalog Number
Enamine	EN300-39045

Database	Data ID
PubChem	24711539

M. W.

175.18726

CAS

Similarity

N/A

ID: 257208

1,2,3,4-tetrahydroquinoline-5-carboxamide

$$$$ Data

M. F.

C10H12N2O

Suppliers	Catalog Number
Enamine	EN300-39046

Database	Data ID
PubChem	18071379

M. W.

176.21508

CAS

Similarity

N/A

ID: 257209

[4-(2-methoxyethoxy)phenyl]methanamine

$$$$ Data

M. F.

C10H15NO2

Suppliers	Catalog Number
ChemBridge	4032445
Enamine	EN300-39047

Database	Data ID
PubChem	20222835

M. W.

181.2316

CAS

102196-20-3

Similarity

N/A

ID: 257210

3-methyl-1,2,3,4-tetrahydroquinoline-8-sulfonamide

$$$$ Data

M. F.

C10H14N2O2S

Suppliers	Catalog Number
Enamine	EN300-39050

Database	Data ID
PubChem	42959251

M. W.

226.29536

CAS

Similarity

N/A

ID: 257211

2-chloro-N-[2-(dimethylamino)-2-phenylethyl]propanamide hydrochloride

$$$$ Data

M. F.

C13H20Cl2N2O

Suppliers	Catalog Number
Enamine	EN300-39054

Database	Data ID
PubChem	43810689

M. W.

291.2167

CAS

Similarity

N/A

ID: 257212

2-amino-1-(3-chlorophenyl)ethan-1-ol

$$$$ Data

M. F.

C8H10ClNO

Suppliers	Catalog Number
Enamine	EN300-39055

Database	Data ID
PubChem	3751601

M. W.

171.6241

CAS

53360-89-7

Similarity

N/A

ID: 257213

2-amino-1-(2-methoxyphenyl)ethan-1-ol

$$$$ Data

M. F.

C9H13NO2

Suppliers	Catalog Number
Enamine	EN300-39056

Database	Data ID
PubChem	3871396

M. W.

167.20502

CAS

54942-63-1

Similarity

N/A

ID: 257214

methyl octahydro-1H-indole-2-carboxylate hydrochloride

$$$$ Data

M. F.

C10H18ClNO2

Suppliers	Catalog Number
Enamine	EN300-39057

Database	Data ID
PubChem	42937516

M. W.

219.70842

CAS

Similarity

N/A

ID: 257215

[2-(diethylamino)ethyl](2-methylpropyl)amine

$$$$ Data

M. F.

C10H24N2

Suppliers	Catalog Number
Enamine	EN300-39063

Database	Data ID
PubChem	20735608

M. W.

172.31096

CAS

Similarity

N/A

ID: 257216

(E)-N-{[3-(pyridin-4-ylmethoxy)phenyl]methylidene}hydroxylamine

$$$$ Data

M. F.

C13H12N2O2

Suppliers	Catalog Number
Enamine	EN300-39064

Database	Data ID
PubChem	42959083

M. W.

228.24658

CAS

Similarity

N/A

ID: 257217

N-{2-[4-(2-chloroacetyl)-2-fluorophenyl]ethyl}acetamide

$$$$ Data

M. F.

C12H13ClFNO2

Suppliers	Catalog Number
Enamine	EN300-39065

Database	Data ID
PubChem	39869913

M. W.

257.6885232

CAS

Similarity

N/A

ID: 257218

2-amino-N,4-dimethylpentanamide hydrochloride

$$$$ Data

M. F.

C7H17ClN2O

Suppliers	Catalog Number
Enamine	EN300-39066

Database	Data ID
PubChem	22906745

M. W.

180.67568

CAS

Similarity

N/A

ID: 257219

N-(piperidin-3-yl)methanesulfonamide

$$$$ Data

M. F.

C6H14N2O2S

Suppliers	Catalog Number
Enamine	EN300-39067

Database	Data ID
PubChem	20113226

M. W.

178.25256

CAS

Similarity

N/A

ID: 257220

3-(3,5-dimethyl-1H-pyrazol-1-yl)aniline

$$$$ Data

M. F.

C11H13N3

Suppliers	Catalog Number
Enamine	EN300-39068

Database	Data ID
PubChem	23004717

M. W.

187.24102

CAS

Similarity

N/A

ID: 257221

1-(2-nitrophenyl)-3-(propan-2-yl)urea

$$$$ Data

M. F.

C10H13N3O3

Suppliers	Catalog Number
Enamine	EN300-39070

Database	Data ID
PubChem	23548355

M. W.

223.22852

CAS

Similarity

N/A

ID: 257222

3-bromo-4-iodobenzoic acid

$$$$ Data

M. F.

C7H4BrIO2

Suppliers	Catalog Number
Enamine	EN300-39071
Bide Pharmatech	BD232238

Database	Data ID
PubChem	16640907

M. W.

326.91393

CAS

249647-24-3

Similarity

N/A

ID: 257223

2-chloro-6-nitroquinoline

$$$$ Data

M. F.

C9H5ClN2O2

Suppliers	Catalog Number
Enamine	EN300-39072
Bide Pharmatech	BD157745

Database	Data ID
PubChem	10921723

M. W.

208.6012

CAS

29969-57-1

Similarity

N/A

ID: 257224

2-{[2-(diethylamino)ethyl]sulfanyl}acetic acid hydrochloride

$$$$ Data

M. F.

C8H18ClNO2S

Suppliers	Catalog Number
Enamine	EN300-39073

Database	Data ID
PubChem	43810692

M. W.

227.75202

CAS

Similarity

N/A

ID: 257225

2-(1H-1,3-benzodiazol-1-yl)pyridine-3-carboxylic acid

$$$$ Data

M. F.

C13H9N3O2

Suppliers	Catalog Number
Enamine	EN300-39075

Database	Data ID
PubChem	16795418

M. W.

239.22946

CAS

Similarity

N/A

ID: 257226

1-(2,4-dichlorobenzoyl)piperazine

$$$$ Data

M. F.

C11H12Cl2N2O

Suppliers	Catalog Number
Enamine	EN300-39076

Database	Data ID
PubChem	2758189

M. W.

259.13178

CAS

563538-34-1

Similarity

N/A

ID: 257227

N-cyclopropyl-4-ethylcyclohexan-1-amine hydrochloride

$$$$ Data

M. F.

C11H22ClN

Suppliers	Catalog Number
Enamine	EN300-39077

Database	Data ID
PubChem	45286061

M. W.

203.75208

CAS

Similarity

N/A

ID: 257228

2-(3,5-dimethylpiperidine-1-carbonyl)aniline

$$$$ Data

M. F.

C14H20N2O

Suppliers	Catalog Number
Enamine	EN300-39078

Database	Data ID
PubChem	16770188

M. W.

232.3214

CAS

Similarity

N/A

ID: 257229

N-cyclopropyl-4-methylcyclohexan-1-amine hydrochloride

$$$$ Data

M. F.

C10H20ClN

Suppliers	Catalog Number
Enamine	EN300-39080

Database	Data ID
PubChem	45286062

M. W.

189.7255

CAS

Similarity

N/A

ID: 257230

2-[(2,2,2-trifluoroethyl)amino]ethan-1-ol

$$$$ Data

M. F.

C4H8F3NO

Suppliers	Catalog Number
Enamine	EN300-39081
A&J Pharmtech	AJA-O18802

Database	Data ID
PubChem	14513794

M. W.

143.1076296

CAS

371-99-3

Similarity

N/A

ID: 257231

1-[(2-tert-butyl-1,3-thiazol-4-yl)methyl]piperazine hydrochloride

$$$$ Data

M. F.

C12H22ClN3S

Suppliers	Catalog Number
Enamine	EN300-39083

Database	Data ID
PubChem	43810693

M. W.

275.84118

CAS

Similarity

N/A

ID: 257232

[2-(dimethylamino)ethyl](2,2,2-trifluoroethyl)amine

$$$$ Data

M. F.

C6H13F3N2

Suppliers	Catalog Number
Enamine	EN300-39084

Database	Data ID
PubChem	18753034

M. W.

170.1760296

CAS

Similarity

N/A

ID: 257233

2-[(diethylamino)methyl]aniline

$$$$ Data

M. F.

C11H18N2

Suppliers	Catalog Number
Enamine	EN300-39085

Database	Data ID
PubChem	6484208

M. W.

178.27402

CAS

Similarity

N/A

ID: 257234

3-(3-chloropropyl)-5,5-dimethylimidazolidine-2,4-dione

$$$$ Data

M. F.

C8H13ClN2O2

Suppliers	Catalog Number
Enamine	EN300-39086

Database	Data ID
PubChem	10655825

M. W.

204.65402

CAS

Similarity

N/A

ID: 257235

N-[5-(4-hydroxyphenyl)-1,3-thiazol-2-yl]acetamide

$$$$ Data

M. F.

C11H10N2O2S

Suppliers	Catalog Number
Enamine	EN300-39087

Database	Data ID
PubChem	39869923

M. W.

234.2743

CAS

Similarity

N/A

ID: 257236

6-(piperazin-1-yl)pyridine-3-carboxamide

$$$$ Data

M. F.

C10H14N4O

Suppliers	Catalog Number
Enamine	EN300-39089

Database	Data ID
PubChem	22028988

M. W.

206.24436

CAS

Similarity

N/A

ID: 257237

3-trifluoromethanesulfonylpropanoic acid

$$$$ Data

M. F.

C4H5F3O4S

Suppliers	Catalog Number
Enamine	EN300-39090

Database	Data ID
PubChem	22376723

M. W.

206.1403096

CAS

Similarity

N/A

ID: 257238

4-chloro-1-fluoro-2-isocyanatobenzene

$$$$ Data

M. F.

C7H3ClFNO

Suppliers	Catalog Number
Enamine	EN300-39092

Database	Data ID
PubChem	16228041

M. W.

171.5562232

CAS

Similarity

N/A

ID: 257239

N-{2-[4-(trifluoromethyl)phenyl]ethyl}-1H-imidazole-1-carboxamide

$$$$ Data

M. F.

C13H12F3N3O

Suppliers	Catalog Number
Enamine	EN300-39093

Database	Data ID
PubChem	39869928

M. W.

283.2490896

CAS

Similarity

N/A

ID: 257240

1-(2-fluorophenyl)-1H-pyrazole-3-carboxylic acid

$$$$ Data

M. F.

C10H7FN2O2

Suppliers	Catalog Number
Enamine	EN300-39094

Database	Data ID
PubChem	33785483

M. W.

206.1731832

CAS

Similarity

N/A

ID: 257241

1-(5-methyl-2-phenyl-1H-imidazol-4-yl)ethan-1-one

$$$$ Data

M. F.

C12H12N2O

Suppliers	Catalog Number
Enamine	EN300-39095

Database	Data ID
PubChem	328820

M. W.

200.23648

CAS

Similarity

N/A

ID: 257242

1-(5-chlorothiophen-2-yl)ethan-1-ol

$$$$ Data

M. F.

C6H7ClOS

Suppliers	Catalog Number
Enamine	EN300-39097

Database	Data ID
PubChem	15361441

M. W.

162.63718

CAS

Similarity

N/A

ID: 257243

N-(2-aminoethyl)-1-phenylmethanesulfonamide

$$$$ Data

M. F.

C9H14N2O2S

Suppliers	Catalog Number
Enamine	EN300-39098

Database	Data ID
PubChem	20119595

M. W.

214.28466

CAS

Similarity

N/A

ID: 257244

[2-amino-1-(thiophen-3-yl)ethyl]diethylamine

$$$$ Data

M. F.

C10H18N2S

Suppliers	Catalog Number
Enamine	EN300-39099

Database	Data ID
PubChem	16785048

M. W.

198.32832

CAS

Similarity

N/A

ID: 257245

methyl(pentan-2-yl)amine hydrochloride

$$$$ Data

M. F.

C6H16ClN

Suppliers	Catalog Number
Enamine	EN300-39100

Database	Data ID
PubChem	42919600

M. W.

137.65094

CAS

Similarity

N/A

ID: 257246

2-[(ethoxycarbonyl)(methyl)amino]acetic acid

$$$$ Data

M. F.

C6H11NO4

Suppliers	Catalog Number
Enamine	EN300-39101

Database	Data ID
PubChem	22107645

M. W.

161.15584

CAS

Similarity

N/A

ID: 257247

3-(thiophen-2-ylmethoxy)benzoic acid

$$$$ Data

M. F.

C12H10O3S

Suppliers	Catalog Number
Enamine	EN300-39104

Database	Data ID
PubChem	18071667

M. W.

234.271

CAS

Similarity

N/A

ID: 257248

1-(3-methylbutan-2-yl)-1H-pyrazol-5-amine

$$$$ Data

M. F.

C8H15N3

Suppliers	Catalog Number
ChemBridge	4014315
Enamine	EN300-39107

Database	Data ID
PubChem	16782262

M. W.

153.2248

CAS

1015845-91-6

Similarity

N/A

ID: 257249

bis(propan-2-yl) [(4-methylbenzenesulfonyl)oxy]methanephosphonate

$$$$ Data

M. F.

C14H23O6PS

Suppliers	Catalog Number
Enamine	EN300-39109

Database	Data ID
PubChem	10893487

M. W.

350.367581

CAS

35717-98-7

Similarity

N/A

ID: 257250

2-[(2,6-dimethylmorpholin-4-yl)sulfonyl]ethan-1-amine

$$$$ Data

M. F.

C8H18N2O3S

Suppliers	Catalog Number
Enamine	EN300-39110

Database	Data ID
PubChem	42935473

M. W.

222.30512

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