Chembase list of 866358 unique molecular structures

1-(4-chlorophenyl)-3,3-dimethylbutan-2-amine hydrochloride

$$$$ Data

M. F.

C12H19Cl2N

Suppliers	Catalog Number
Enamine	EN300-79177

Database	Data ID
PubChem	54593842

M. W.

248.19196

CAS

Similarity

N/A

ID: 275752

methyl (3R)-3-hydroxy-3-(2-methylphenyl)propanoate hydrochloride

$$$$ Data

M. F.

C11H15ClO3

Suppliers	Catalog Number
Enamine	EN300-79178

Database	Data ID
PubChem	54593844

M. W.

230.688

CAS

Similarity

N/A

ID: 275753

N'-hydroxy-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]ethanimidamide

$$$$ Data

M. F.

C12H13N3OS

Suppliers	Catalog Number
Enamine	EN300-79179

Database	Data ID
PubChem	9660824

M. W.

247.31612

CAS

Similarity

N/A

ID: 275754

2-hydroxy-2-(oxan-4-yl)acetic acid

$$$$ Data

M. F.

C7H12O4

Suppliers	Catalog Number
Enamine	EN300-79180

Database	Data ID
PubChem	54593845

M. W.

160.16778

CAS

Similarity

N/A

ID: 275755

2-[(2,2-dimethylpropyl)amino]-1-phenylethan-1-ol hydrochloride

$$$$ Data

M. F.

C13H22ClNO

Suppliers	Catalog Number
Enamine	EN300-79182

Database	Data ID
PubChem	54593846

M. W.

243.77288

CAS

Similarity

N/A

ID: 275756

N-(1-cyanopropyl)benzamide

$$$$ Data

M. F.

C11H12N2O

Suppliers	Catalog Number
Enamine	EN300-79183

Database	Data ID
PubChem	4536051

M. W.

188.22578

CAS

Similarity

N/A

ID: 275757

N-(1-carbamothioyl-1-methylethyl)benzamide

$$$$ Data

M. F.

C11H14N2OS

Suppliers	Catalog Number
Enamine	EN300-79184

Database	Data ID
PubChem	54593848

M. W.

222.30666

CAS

Similarity

N/A

ID: 275758

1-methyl-1H-pyrazole-4-carbohydrazide

$$$$ Data

M. F.

C5H8N4O

Suppliers	Catalog Number
ChemBridge	4036324
Enamine	EN300-79185

Database	Data ID
PubChem	7017670

M. W.

140.14322

CAS

170020-91-4

Similarity

N/A

ID: 275759

2-(4-bromo-2-methylphenyl)-1λ⁶,2-thiazolidine-1,1-dione

$$$$ Data

M. F.

C10H12BrNO2S

Suppliers	Catalog Number
Enamine	EN300-79186

Database	Data ID
PubChem	24698259

M. W.

290.17678

CAS

Similarity

N/A

ID: 275760

5-(1-methyl-1H-pyrazol-4-yl)-1,3,4-oxadiazol-2-amine

$$$$ Data

M. F.

C6H7N5O

Suppliers	Catalog Number
Enamine	EN300-79187

Database	Data ID
PubChem	28742871

M. W.

165.15268

CAS

Similarity

N/A

ID: 275761

1-(1-phenylethyl)piperidin-4-amine

$$$$ Data

M. F.

C13H20N2

Suppliers	Catalog Number
Enamine	EN300-79189

Database	Data ID
PubChem	12641844

M. W.

204.3113

CAS

Similarity

N/A

ID: 275762

2-(dimethyl-1,3-thiazol-2-yl)propan-2-amine

$$$$ Data

M. F.

C8H14N2S

Suppliers	Catalog Number
Enamine	EN300-79190

Database	Data ID
PubChem	28286209

M. W.

170.27516

CAS

Similarity

N/A

ID: 275763

ethyl 2,3-difluoro-5-nitrobenzoate

$$$$ Data

M. F.

C9H7F2NO4

Suppliers	Catalog Number
Enamine	EN300-79191

Database	Data ID
PubChem	54593849

M. W.

231.1529864

CAS

Similarity

N/A

ID: 275764

2-(chloromethyl)-1,3-thiazole

$$$$ Data

M. F.

C4H4ClNS

Suppliers	Catalog Number
ChemBridge	4016914
Enamine	EN300-79192
A&J Pharmtech	AJA-O25769

Database	Data ID
PubChem	14090864

M. W.

133.59926

CAS

3364-78-1

Similarity

N/A

ID: 275765

ethyl 2-hydroxy-2-(oxolan-3-yl)acetate

$$$$ Data

M. F.

C8H14O4

Suppliers	Catalog Number
Enamine	EN300-79193

Database	Data ID
PubChem	15415399

M. W.

174.19436

CAS

Similarity

N/A

ID: 275766

[5-(2,3-dihydro-1,4-benzodioxin-2-yl)-1,2,4-oxadiazol-3-yl]methanamine

$$$$ Data

M. F.

C11H11N3O3

Suppliers	Catalog Number
Enamine	EN300-79197

Database	Data ID
PubChem	54593850

M. W.

233.22334

CAS

Similarity

N/A

ID: 275767

2-(2-aminoethyl)-1,2-dihydrophthalazin-1-one

$$$$ Data

M. F.

C10H11N3O

Suppliers	Catalog Number
ChemBridge	4028929
Enamine	EN300-79199

Database	Data ID
PubChem	10702810

M. W.

189.21384

CAS

Similarity

N/A

ID: 275768

3-(phenylmethanesulfonylmethyl)aniline

$$$$ Data

M. F.

C14H15NO2S

Suppliers	Catalog Number
Enamine	EN300-79200

Database	Data ID
PubChem	43382308

M. W.

261.3394

CAS

Similarity

N/A

ID: 275769

2-amino-2,3-dihydro-1H-indene-2-carboxamide hydrochloride

$$$$ Data

M. F.

C10H13ClN2O

Suppliers	Catalog Number
Enamine	EN300-79201

Database	Data ID
PubChem	54593851

M. W.

212.67602

CAS

Similarity

N/A

ID: 275770

oxolane-2-carboxamide

$$$$ Data

M. F.

C5H9NO2

Suppliers	Catalog Number
Enamine	EN300-79202

Database	Data ID
PubChem	3544692

M. W.

115.13046

CAS

Similarity

N/A

ID: 275771

2-amino-2-(4-methoxyphenyl)propanoic acid hydrochloride

$$$$ Data

M. F.

C10H14ClNO3

Suppliers	Catalog Number
Enamine	EN300-79203

Database	Data ID
PubChem	53414089

M. W.

231.67606

CAS

Similarity

N/A

ID: 275772

4-amino-N-{3-[(dimethylamino)methyl]phenyl}-1,2,5-oxadiazole-3-carboxamide

$$$$ Data

M. F.

C12H15N5O2

Suppliers	Catalog Number
Enamine	EN300-79204

Database	Data ID
PubChem	54593853

M. W.

261.2798

CAS

Similarity

N/A

ID: 275773

3-bromo-4-methoxy-N-methylbenzene-1-sulfonamide

$$$$ Data

M. F.

C8H10BrNO3S

Suppliers	Catalog Number
Enamine	EN300-79205

Database	Data ID
PubChem	28384691

M. W.

280.1389

CAS

Similarity

N/A

ID: 275774

ethyl 4-amino-3-hydroxybenzoate

$$$$ Data

M. F.

C9H11NO3

Suppliers	Catalog Number
Enamine	EN300-79206

Database	Data ID
PubChem	12784565

M. W.

181.18854

CAS

Similarity

N/A

ID: 275775

3-[(benzylsulfanyl)methyl]aniline

$$$$ Data

M. F.

C14H15NS

Suppliers	Catalog Number
Enamine	EN300-79208

Database	Data ID
PubChem	28402052

M. W.

229.3406

CAS

Similarity

N/A

ID: 275776

{2-[(4-methylpiperazin-1-yl)sulfonyl]phenyl}methanamine

$$$$ Data

M. F.

C12H19N3O2S

Suppliers	Catalog Number
Enamine	EN300-79209

Database	Data ID
PubChem	16784819

M. W.

269.36316

CAS

Similarity

N/A

ID: 275777

[cyclopropyl(isothiocyanato)methyl]cyclopropane

$$$$ Data

M. F.

C8H11NS

Suppliers	Catalog Number
Enamine	EN300-79210

Database	Data ID
PubChem	54593854

M. W.

153.24464

CAS

Similarity

N/A

ID: 275778

(3-amino-4,4-dimethylpentyl)dimethylamine

$$$$ Data

M. F.

C9H22N2

Suppliers	Catalog Number
Enamine	EN300-79211

Database	Data ID
PubChem	54593855

M. W.

158.28438

CAS

Similarity

N/A

ID: 275779

3-(4-chlorophenyl)thiomorpholine

$$$$ Data

M. F.

C10H12ClNS

Suppliers	Catalog Number
Enamine	EN300-79212

Database	Data ID
PubChem	49756522

M. W.

213.72698

CAS

Similarity

N/A

ID: 275780

2-(2-bromophenyl)-4-methyl-1,3-thiazole

$$$$ Data

M. F.

C10H8BrNS

Suppliers	Catalog Number
Enamine	EN300-79213

Database	Data ID
PubChem	54593856

M. W.

254.14622

CAS

Similarity

N/A

ID: 275781

2-(3-bromophenyl)-4-methyl-1,3-thiazole

$$$$ Data

M. F.

C10H8BrNS

Suppliers	Catalog Number
Enamine	EN300-79214

Database	Data ID
PubChem	54593857

M. W.

254.14622

CAS

Similarity

N/A

ID: 275782

2-(4-bromophenyl)-4-methyl-1,3-thiazole

$$$$ Data

M. F.

C10H8BrNS

Suppliers	Catalog Number
Enamine	EN300-79215

Database	Data ID
PubChem	54593858

M. W.

254.14622

CAS

Similarity

N/A

ID: 275783

2-(4-bromophenyl)-1,3-thiazole

$$$$ Data

M. F.

C9H6BrNS

Suppliers	Catalog Number
Enamine	EN300-79216

Database	Data ID
PubChem	13546651

M. W.

240.11964

CAS

Similarity

N/A

ID: 275784

2-(3-bromophenyl)-1,3-thiazole

$$$$ Data

M. F.

C9H6BrNS

Suppliers	Catalog Number
Enamine	EN300-79217

Database	Data ID
PubChem	53407338

M. W.

240.11964

CAS

Similarity

N/A

ID: 275785

2-(2-bromophenyl)-1,3-thiazole

$$$$ Data

M. F.

C9H6BrNS

Suppliers	Catalog Number
Enamine	EN300-79218

Database	Data ID
PubChem	19369924

M. W.

240.11964

CAS

Similarity

N/A

ID: 275786

2-(2-bromophenyl)-4-cyclopropyl-1,3-thiazole

$$$$ Data

M. F.

C12H10BrNS

Suppliers	Catalog Number
Enamine	EN300-79219

Database	Data ID
PubChem	54593859

M. W.

280.1835

CAS

Similarity

N/A

ID: 275787

(1S)-1-[3-(difluoromethoxy)phenyl]ethan-1-ol

$$$$ Data

M. F.

C9H10F2O2

Suppliers	Catalog Number
Enamine	EN300-79221

Database	Data ID
PubChem	29892854

M. W.

188.1713064

CAS

Similarity

N/A

ID: 275788

2-(3-bromophenyl)-4-cyclopropyl-1,3-thiazole

$$$$ Data

M. F.

C12H10BrNS

Suppliers	Catalog Number
Enamine	EN300-79222

Database	Data ID
PubChem	54593860

M. W.

280.1835

CAS

Similarity

N/A

ID: 275789

1-(3-methoxypropyl)-1H-pyrazol-3-amine

$$$$ Data

M. F.

C7H13N3O

Suppliers	Catalog Number
Enamine	EN300-79223

Database	Data ID
PubChem	54593861

M. W.

155.19762

CAS

Similarity

N/A

ID: 275790

4-(3-amino-1H-pyrazol-1-yl)-N,N-dimethylbutanamide

$$$$ Data

M. F.

C9H16N4O

Suppliers	Catalog Number
Enamine	EN300-79224

Database	Data ID
PubChem	54593862

M. W.

196.24954

CAS

Similarity

N/A

ID: 275791

2-(4-bromophenyl)-4-cyclopropyl-1,3-thiazole

$$$$ Data

M. F.

C12H10BrNS

Suppliers	Catalog Number
Enamine	EN300-79225

Database	Data ID
PubChem	54593863

M. W.

280.1835

CAS

Similarity

N/A

ID: 275792

3-(5-methylfuran-2-yl)morpholine

$$$$ Data

M. F.

C9H13NO2

Suppliers	Catalog Number
Enamine	EN300-79226

Database	Data ID
PubChem	54593864

M. W.

167.20502

CAS

Similarity

N/A

ID: 275793

(1R)-1-[3-(difluoromethoxy)phenyl]ethan-1-ol

$$$$ Data

M. F.

C9H10F2O2

Suppliers	Catalog Number
Enamine	EN300-79227

Database	Data ID
PubChem	29892852

M. W.

188.1713064

CAS

Similarity

N/A

ID: 275794

3-(2-methylphenyl)butanoic acid

$$$$ Data

M. F.

C11H14O2

Suppliers	Catalog Number
Enamine	EN300-79229

Database	Data ID
PubChem	12540160

M. W.

178.22766

CAS

Similarity

N/A

ID: 275795

3-(3-bromophenyl)-1,2,4-oxadiazole

$$$$ Data

M. F.

C8H5BrN2O

Suppliers	Catalog Number
Enamine	EN300-79232

Database	Data ID
PubChem	21942419

M. W.

225.0421

CAS

Similarity

N/A

ID: 275796

3-(2-bromophenyl)-1,2,4-oxadiazole

$$$$ Data

M. F.

C8H5BrN2O

Suppliers	Catalog Number
Enamine	EN300-79233

Database	Data ID
PubChem	21710590

M. W.

225.0421

CAS

Similarity

N/A

ID: 275797

2-(ethylsulfanyl)phenol

$$$$ Data

M. F.

C8H10OS

Suppliers	Catalog Number
Enamine	EN300-79236

Database	Data ID
PubChem	122407

M. W.

154.2294

CAS

Similarity

N/A

ID: 275798

3-(4-bromophenyl)-5-ethyl-1,2,4-oxadiazole

$$$$ Data

M. F.

C10H9BrN2O

Suppliers	Catalog Number
Enamine	EN300-79238

Database	Data ID
PubChem	739568

M. W.

253.09526

CAS

Similarity

N/A

ID: 275799

2-(2,5-dichlorophenyl)ethan-1-amine hydrochloride

$$$$ Data

M. F.

C8H10Cl3N

Suppliers	Catalog Number
Enamine	EN300-79239

Database	Data ID
PubChem	54593865

M. W.

226.5307

CAS

Similarity

N/A

ID: 275800

3-(3-bromophenyl)-5-ethyl-1,2,4-oxadiazole

$$$$ Data

M. F.

C10H9BrN2O

Suppliers	Catalog Number
Enamine	EN300-79240

Database	Data ID
PubChem	46739330

M. W.

253.09526

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