Chembase list of 866358 unique molecular structures

3-(aminomethyl)-N-phenylbenzamide hydrochloride

$$$$ Data

M. F.

C14H15ClN2O

Suppliers	Catalog Number
Enamine	EN300-40295

Database	Data ID
PubChem	43810731

M. W.

262.7347

CAS

Similarity

N/A

ID: 257952

2-(pyridin-2-yl)ethane-1-sulfonyl chloride hydrochloride

$$$$ Data

M. F.

C7H9Cl2NO2S

Suppliers	Catalog Number
Enamine	EN300-40296

Database	Data ID
PubChem	21983734

M. W.

242.12286

CAS

Similarity

N/A

ID: 257953

4-benzyl-5-phenyl-1,3-thiazol-2-amine

$$$$ Data

M. F.

C16H14N2S

Suppliers	Catalog Number
Enamine	EN300-40297

Database	Data ID
PubChem	17860310

M. W.

266.36076

CAS

Similarity

N/A

ID: 257954

methyl({5H,6H,7H,8H,9H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl})amine dihydrochl...

$$$$ Data

M. F.

C9H18Cl2N4

Suppliers	Catalog Number
Enamine	EN300-40298

Database	Data ID
PubChem	43810732

M. W.

253.17202

CAS

Similarity

N/A

ID: 257955

[4-(oxolan-2-ylmethoxy)phenyl]methanamine

$$$$ Data

M. F.

C12H17NO2

Suppliers	Catalog Number
Enamine	EN300-40300

Database	Data ID
PubChem	16770519

M. W.

207.26888

CAS

Similarity

N/A

ID: 257956

1,3-benzothiazol-6-amine hydrochloride

$$$$ Data

M. F.

C7H7ClN2S

Suppliers	Catalog Number
Enamine	EN300-40301

Database	Data ID
PubChem	23373997

M. W.

186.66188

CAS

Similarity

N/A

ID: 257957

1-(3-methylbutyl)piperazine dihydrochloride

$$$$ Data

M. F.

C9H22Cl2N2

Suppliers	Catalog Number
Enamine	EN300-40302

Database	Data ID
PubChem	42933715

M. W.

229.19038

CAS

Similarity

N/A

ID: 257958

1-[8-chloro-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]ethan-1-amine...

$$$$ Data

M. F.

C9H9Cl2F3N4

Suppliers	Catalog Number
Enamine	EN300-40305

Database	Data ID
PubChem	43810733

M. W.

301.0957696

CAS

Similarity

N/A

ID: 257959

2-(2-phenoxyethoxy)acetic acid

$$$$ Data

M. F.

C10H12O4

Suppliers	Catalog Number
Enamine	EN300-40307

Database	Data ID
PubChem	4291934

M. W.

196.19988

CAS

Similarity

N/A

ID: 257960

2-amino-4-methanesulfonyl-N,N-dimethylbutanamide hydrobromide

$$$$ Data

M. F.

C7H17BrN2O3S

Suppliers	Catalog Number
Enamine	EN300-40309

Database	Data ID
PubChem	42948602

M. W.

289.19048

CAS

Similarity

N/A

ID: 257961

2-(5-bromo-2-fluorophenyl)acetonitrile

$$$$ Data

M. F.

C8H5BrFN

Suppliers	Catalog Number
Enamine	EN300-40311
Bide Pharmatech	BD231731
A&J Pharmtech	AJA-O37

Database	Data ID
PubChem	23509631

M. W.

214.0344032

CAS

305800-60-6

Similarity

N/A

ID: 257962

N-(5-amino-2-fluorophenyl)benzenesulfonamide

$$$$ Data

M. F.

C12H11FN2O2S

Suppliers	Catalog Number
Enamine	EN300-40312

Database	Data ID
PubChem	16771005

M. W.

266.2913432

CAS

Similarity

N/A

ID: 257963

(5-ethylthiophen-2-yl)methanamine

$$$$ Data

M. F.

C7H11NS

Suppliers	Catalog Number
Enamine	EN300-40315

Database	Data ID
PubChem	3801349

M. W.

141.23394

CAS

Similarity

N/A

ID: 257964

N-phenylpiperidine-1-carbothioamide

$$$$ Data

M. F.

C12H16N2S

Suppliers	Catalog Number
Enamine	EN300-40316

Database	Data ID
PubChem	698365

M. W.

220.33384

CAS

Similarity

N/A

ID: 257965

{4-[(2-methylpiperidin-1-yl)methyl]phenyl}methanamine

$$$$ Data

M. F.

C14H22N2

Suppliers	Catalog Number
Enamine	EN300-40319

Database	Data ID
PubChem	16769219

M. W.

218.33788

CAS

Similarity

N/A

ID: 257966

{2-[(4-methylpiperidin-1-yl)methyl]phenyl}methanamine

$$$$ Data

M. F.

C14H22N2

Suppliers	Catalog Number
Enamine	EN300-40320

Database	Data ID
PubChem	16228068

M. W.

218.33788

CAS

Similarity

N/A

ID: 257967

4-(bromomethyl)-2-phenyl-2H-1,2,3-triazole

$$$$ Data

M. F.

C9H8BrN3

Suppliers	Catalog Number
Enamine	EN300-40322

Database	Data ID
PubChem	708483

M. W.

238.08392

CAS

Similarity

N/A

ID: 257968

(2-phenyl-2H-1,2,3-triazol-4-yl)methanol

$$$$ Data

M. F.

C9H9N3O

Suppliers	Catalog Number
Enamine	EN300-40323

Database	Data ID
PubChem	707096

M. W.

175.18726

CAS

Similarity

N/A

ID: 257969

N-[4-amino-3-(trifluoromethyl)phenyl]-4-fluorobenzamide

$$$$ Data

M. F.

C14H10F4N2O

Suppliers	Catalog Number
Enamine	EN300-40324

Database	Data ID
PubChem	16772871

M. W.

298.2356128

CAS

Similarity

N/A

ID: 257970

2-(3-fluoro-4-methoxy-5-sulfamoylphenyl)acetic acid

$$$$ Data

M. F.

C9H10FNO5S

Suppliers	Catalog Number
Enamine	EN300-40325

Database	Data ID
PubChem	16772794

M. W.

263.2428032

CAS

Similarity

N/A

ID: 257971

{4-[2-(diethylamino)ethoxy]phenyl}methanamine

$$$$ Data

M. F.

C13H22N2O

Suppliers	Catalog Number
Enamine	EN300-40327

Database	Data ID
PubChem	235944

M. W.

222.32658

CAS

Similarity

N/A

ID: 257972

{1-[(2-fluorophenyl)methyl]-1H-1,3-benzodiazol-2-yl}methanol

$$$$ Data

M. F.

C15H13FN2O

Suppliers	Catalog Number
ChemBridge	6281686
Enamine	EN300-40328

Database	Data ID
PubChem	761911

M. W.

256.2749232

CAS

309938-27-0

Similarity

N/A

ID: 257973

(E)-3-(1H-1,3-benzodiazol-1-yl)-N'-hydroxypropimidamide

$$$$ Data

M. F.

C10H12N4O

Suppliers	Catalog Number
Enamine	EN300-40331

Database	Data ID
PubChem	17010602

M. W.

204.22848

CAS

Similarity

N/A

ID: 257974

(Z)-3-(5,6-dimethyl-1H-1,3-benzodiazol-1-yl)-N'-hydroxypropimidamide

$$$$ Data

M. F.

C12H16N4O

Suppliers	Catalog Number
Enamine	EN300-40332

Database	Data ID
PubChem	16450492

M. W.

232.28164

CAS

Similarity

N/A

ID: 257975

3-(5,6-dimethyl-1H-1,3-benzodiazol-1-yl)propanamide

$$$$ Data

M. F.

C12H15N3O

Suppliers	Catalog Number
Enamine	EN300-40333

Database	Data ID
PubChem	639429

M. W.

217.267

CAS

Similarity

N/A

ID: 257976

(Z)-2-(5,6-dimethyl-1H-1,3-benzodiazol-1-yl)-N'-hydroxyethenimidamide

$$$$ Data

M. F.

C11H14N4O

Suppliers	Catalog Number
Enamine	EN300-40339

Database	Data ID
PubChem	17010606

M. W.

218.25506

CAS

Similarity

N/A

ID: 257977

2-(1H-1,3-benzodiazol-2-yl)propan-2-ol

$$$$ Data

M. F.

C10H12N2O

Suppliers	Catalog Number
Enamine	EN300-40340

Database	Data ID
PubChem	12258664

M. W.

176.21508

CAS

Similarity

N/A

ID: 257978

4-ethylcyclohex-1-ene-1-carbonitrile

$$$$ Data

M. F.

C9H13N

Suppliers	Catalog Number
Enamine	EN300-40344

Database	Data ID
PubChem	50987857

M. W.

135.20622

CAS

Similarity

N/A

ID: 257979

methyl(2-methylbutyl)amine

$$$$ Data

M. F.

C6H15N

Suppliers	Catalog Number
Enamine	EN300-40351

Database	Data ID
PubChem	12998589

M. W.

101.19

CAS

Similarity

N/A

ID: 257980

N-methylthiolan-3-amine

$$$$ Data

M. F.

C5H11NS

Suppliers	Catalog Number
Enamine	EN300-40352

Database	Data ID
PubChem	16793953

M. W.

117.21254

CAS

Similarity

N/A

ID: 257981

3-phenyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxylic acid

$$$$ Data

M. F.

C13H8N2O3

Suppliers	Catalog Number
Enamine	EN300-40353

Database	Data ID
PubChem	16788564

M. W.

240.21422

CAS

Similarity

N/A

ID: 257982

5-(2-aminoethyl)thiophene-2-sulfonamide hydrochloride

$$$$ Data

M. F.

C6H11ClN2O2S2

Suppliers	Catalog Number
Enamine	EN300-40354

Database	Data ID
PubChem	20203298

M. W.

242.74674

CAS

Similarity

N/A

ID: 257983

4-(1,4-diazepan-1-yl)benzonitrile

$$$$ Data

M. F.

C12H15N3

Suppliers	Catalog Number
Enamine	EN300-40355

Database	Data ID
PubChem	28410929

M. W.

201.2676

CAS

303134-11-4

Similarity

N/A

ID: 257984

2-amino-N,N-dimethylpropanamide

$$$$ Data

M. F.

C5H12N2O

Suppliers	Catalog Number
ChemBridge	4033000
Enamine	EN300-40356

Database	Data ID
PubChem	12653781

M. W.

116.16158

CAS

124491-96-9

Similarity

N/A

ID: 257985

1-(pyridin-2-yl)piperidin-4-amine

$$$$ Data

M. F.

C10H15N3

Suppliers	Catalog Number
Enamine	EN300-40358
Bide Pharmatech	BD60387

Database	Data ID
PubChem	10197934

M. W.

177.2462

CAS

144465-94-1

Similarity

N/A

ID: 257986

ethyl 4-(carbamoylamino)piperidine-1-carboxylate

$$$$ Data

M. F.

C9H17N3O3

Suppliers	Catalog Number
Enamine	EN300-40359

Database	Data ID
PubChem	17830258

M. W.

215.24958

CAS

Similarity

N/A

ID: 257987

(pyridin-2-ylmethyl)urea

$$$$ Data

M. F.

C7H9N3O

Suppliers	Catalog Number
Enamine	EN300-40360

Database	Data ID
PubChem	705533

M. W.

151.16586

CAS

Similarity

N/A

ID: 257988

5,6-difluoro-2,3-dihydro-1H-indole

$$$$ Data

M. F.

C8H7F2N

Suppliers	Catalog Number
Enamine	EN300-40363
Bide Pharmatech	BD159955

Database	Data ID
PubChem	16792594

M. W.

155.1446864

CAS

954255-04-0

Similarity

N/A

ID: 257989

tert-butyl 4-oxo-1-azaspiro[5.5]undecane-1-carboxylate

$$$$ Data

M. F.

C15H25NO3

Suppliers	Catalog Number
Enamine	EN300-40364

Database	Data ID
PubChem	16300344

M. W.

267.3639

CAS

Similarity

N/A

ID: 257990

bis(1H-pyrazol-4-ylmethanamine) trihydrochloride

$$$$ Data

M. F.

C8H17Cl3N6

Suppliers	Catalog Number
Enamine	EN300-40369

Database	Data ID
PubChem	43810734

M. W.

303.61978

CAS

Similarity

N/A

ID: 257991

3-(dimethylamino)propanenitrile hydrochloride

$$$$ Data

M. F.

C5H11ClN2

Suppliers	Catalog Number
Enamine	EN300-40370

Database	Data ID
PubChem	205493

M. W.

134.60724

CAS

Similarity

N/A

ID: 257992

6,7-dimethyl 5-(3-aminophenyl)-2,3-dihydro-1H-pyrrolizine-6,7-dicarboxylate

$$$$ Data

M. F.

C17H18N2O4

Suppliers	Catalog Number
Enamine	EN300-40372

Database	Data ID
PubChem	39870330

M. W.

314.33582

CAS

Similarity

N/A

ID: 257993

1-{3-[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]propyl}piperazine dihydrochloride

$$$$ Data

M. F.

C13H20Cl2N4OS

Suppliers	Catalog Number
Enamine	EN300-40373

Database	Data ID
PubChem	43810735

M. W.

351.2951

CAS

Similarity

N/A

ID: 257994

2-[(3,5-dichloropyridin-2-yl)oxy]aniline

$$$$ Data

M. F.

C11H8Cl2N2O

Suppliers	Catalog Number
Enamine	EN300-40374

Database	Data ID
PubChem	16775589

M. W.

255.10002

CAS

Similarity

N/A

ID: 257995

1-[(3-fluorophenyl)methyl]piperidine-3-carboxylic acid hydrochloride

$$$$ Data

M. F.

C13H17ClFNO2

Suppliers	Catalog Number
Enamine	EN300-40375

Database	Data ID
PubChem	42935485

M. W.

273.7309832

CAS

Similarity

N/A

ID: 257996

1-(3-bromophenyl)pyrrolidin-2-one

$$$$ Data

M. F.

C10H10BrNO

Suppliers	Catalog Number
Enamine	EN300-40376

Database	Data ID
PubChem	899668

M. W.

240.0965

CAS

Similarity

N/A

ID: 257997

[4-(pyridin-3-ylmethoxy)phenyl]methanamine

$$$$ Data

M. F.

C13H14N2O

Suppliers	Catalog Number
Enamine	EN300-40377

Database	Data ID
PubChem	16776880

M. W.

214.26306

CAS

Similarity

N/A

ID: 257998

ethyl 2-amino-3-oxobutanoate hydrochloride

$$$$ Data

M. F.

C6H12ClNO3

Suppliers	Catalog Number
Enamine	EN300-40378
Bide Pharmatech	BD208560

Database	Data ID
PubChem	13282897

M. W.

181.61738

CAS

20207-16-3

Similarity

N/A

ID: 257999

2-(1H-imidazol-1-yl)-5-(trifluoromethyl)aniline dihydrochloride

$$$$ Data

M. F.

C10H10Cl2F3N3

Suppliers	Catalog Number
Enamine	EN300-40379

Database	Data ID
PubChem	43810736

M. W.

300.1077096

CAS

Similarity

N/A

ID: 258000

2-(1H-1,2,3-triazol-1-yl)aniline hydrochloride

$$$$ Data

M. F.

C8H9ClN4

Suppliers	Catalog Number
Enamine	EN300-40381

Database	Data ID
PubChem	42940669

M. W.

196.63686

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