Chembase list of 866358 unique molecular structures

N-(2-fluorophenyl)-2-(piperazin-1-yl)acetamide hydrochloride

$$$$ Data

M. F.

C12H17ClFN3O

Suppliers	Catalog Number
Enamine	EN300-118247

Database	Data ID
PubChem	71757254

M. W.

273.7342832

CAS

Similarity

N/A

ID: 243452

N-(4-chlorophenyl)-2-(piperazin-1-yl)acetamide hydrochloride

$$$$ Data

M. F.

C12H17Cl2N3O

Suppliers	Catalog Number
Enamine	EN300-118248

Database	Data ID
PubChem	71757255

M. W.

290.18888

CAS

Similarity

N/A

ID: 243453

tert-butyl 3-[(butan-2-yl)amino]propanoate

$$$$ Data

M. F.

C11H23NO2

Suppliers	Catalog Number
Enamine	EN300-118249

Database	Data ID
PubChem	46318494

M. W.

201.30582

CAS

Similarity

N/A

ID: 243454

1-N-cyclohexylbenzene-1,2-diamine

$$$$ Data

M. F.

C12H18N2

Suppliers	Catalog Number
Enamine	EN300-11825

Database	Data ID
PubChem	1517328

M. W.

190.28472

CAS

74628-31-2

Similarity

N/A

ID: 243455

N-[3-(morpholin-4-yl)propyl]aniline

$$$$ Data

M. F.

C13H20N2O

Suppliers	Catalog Number
Enamine	EN300-118250

Database	Data ID
PubChem	59526603

M. W.

220.3107

CAS

Similarity

N/A

ID: 243456

2-N-methylpyridine-2,5-diamine hydrochloride

$$$$ Data

M. F.

C6H10ClN3

Suppliers	Catalog Number
Enamine	EN300-118254

Database	Data ID
PubChem	66524814

M. W.

159.6167

CAS

Similarity

N/A

ID: 243457

2-chloro-N-[(5-chlorothiophen-2-yl)methyl]-N-methylacetamide

$$$$ Data

M. F.

C8H9Cl2NOS

Suppliers	Catalog Number
Enamine	EN300-11826

Database	Data ID
PubChem	2465947

M. W.

238.13416

CAS

Similarity

N/A

ID: 243458

4-chloro-2-[(2-methoxyphenyl)amino]-1,3-thiazole-5-carbaldehyde

$$$$ Data

M. F.

C11H9ClN2O2S

Suppliers	Catalog Number
Enamine	EN300-11827

Database	Data ID
PubChem	2525957

M. W.

268.71936

CAS

Similarity

N/A

ID: 243459

[1-(prop-2-yn-1-yl)cyclobutyl]methanol

$$$$ Data

M. F.

C8H12O

Suppliers	Catalog Number
Enamine	EN300-118274

Database	Data ID
PubChem	71757256

M. W.

124.18028

CAS

Similarity

N/A

ID: 243460

4-(chloromethyl)-N,N-dimethylfuran-2-sulfonamide

$$$$ Data

M. F.

C7H10ClNO3S

Suppliers	Catalog Number
Enamine	EN300-118279

Database	Data ID
PubChem	71757257

M. W.

223.6772

CAS

Similarity

N/A

ID: 243461

6-(tert-butoxy)pyridine-3-carboximidamide

$$$$ Data

M. F.

C10H15N3O

Suppliers	Catalog Number
Enamine	EN300-118280

Database	Data ID
PubChem	29002851

M. W.

193.2456

CAS

Similarity

N/A

ID: 243462

1'-methyl-3,4-dihydrospiro[1-benzopyran-2,4'-piperidine]-4-one

$$$$ Data

M. F.

C14H17NO2

Suppliers	Catalog Number
Enamine	EN300-118282

Database	Data ID
PubChem	1233903

M. W.

231.29028

CAS

Similarity

N/A

ID: 243463

1-(1H-imidazol-4-yl)-3-phenylpropan-2-amine dihydrochloride

$$$$ Data

M. F.

C12H17Cl2N3

Suppliers	Catalog Number
Enamine	EN300-118284

Database	Data ID
PubChem	71757258

M. W.

274.18948

CAS

Similarity

N/A

ID: 243464

5,7-dimethylquinolin-2-amine

$$$$ Data

M. F.

C11H12N2

Suppliers	Catalog Number
Enamine	EN300-118285

Database	Data ID
PubChem	64208470

M. W.

172.22638

CAS

Similarity

N/A

ID: 243465

5,7-dichloroquinolin-2-amine

$$$$ Data

M. F.

C9H6Cl2N2

Suppliers	Catalog Number
Enamine	EN300-118286

Database	Data ID
PubChem	64208704

M. W.

213.06334

CAS

Similarity

N/A

ID: 243466

2-[4-(bromomethyl)phenoxymethyl]oxolane

$$$$ Data

M. F.

C12H15BrO2

Suppliers	Catalog Number
Enamine	EN300-118287

Database	Data ID
PubChem	43141534

M. W.

271.1503

CAS

Similarity

N/A

ID: 243467

2-chloro-6-{5H,6H,7H,8H-imidazo[1,2-a]pyrazin-7-yl}pyridine-4-carboxylic acid

$$$$ Data

M. F.

C12H11ClN4O2

Suppliers	Catalog Number
Enamine	EN300-118288

Database	Data ID
PubChem	63024771

M. W.

278.69434

CAS

Similarity

N/A

ID: 243468

(2-chloro-4,5-dimethylphenyl)methanol

$$$$ Data

M. F.

C9H11ClO

Suppliers	Catalog Number
Enamine	EN300-118290

Database	Data ID
PubChem	71695357

M. W.

170.63604

CAS

Similarity

N/A

ID: 243469

1,3,5-trimethylpiperazine

$$$$ Data

M. F.

C7H16N2

Suppliers	Catalog Number
Enamine	EN300-118291

Database	Data ID
PubChem	17983253

M. W.

128.21534

CAS

Similarity

N/A

ID: 243470

methyl 2-[(2-aminoethyl)(methyl)amino]acetate dihydrochloride

$$$$ Data

M. F.

C6H16Cl2N2O2

Suppliers	Catalog Number
Enamine	EN300-118296

Database	Data ID
PubChem	71757259

M. W.

219.10944

CAS

Similarity

N/A

ID: 243471

2-[(2-methylpropyl)sulfanyl]ethan-1-amine hydrochloride

$$$$ Data

M. F.

C6H16ClNS

Suppliers	Catalog Number
Enamine	EN300-118297

Database	Data ID
PubChem	71757260

M. W.

169.71594

CAS

Similarity

N/A

ID: 243472

1-methoxy-3-(1H-1,2,4-triazol-1-yl)propan-2-ol

$$$$ Data

M. F.

C6H11N3O2

Suppliers	Catalog Number
Enamine	EN300-118298

Database	Data ID
PubChem	63929431

M. W.

157.17044

CAS

Similarity

N/A

ID: 243473

5-methyl-2-[3-(trifluoromethyl)phenyl]-1H-imidazole-4-carboxylic acid

$$$$ Data

M. F.

C12H9F3N2O2

Suppliers	Catalog Number
Enamine	EN300-118299

Database	Data ID
PubChem	43445097

M. W.

270.2072696

CAS

Similarity

N/A

ID: 243474

2-{[1-(3,4-dimethylphenyl)-1H-imidazol-2-yl]sulfanyl}acetic acid

$$$$ Data

M. F.

C13H14N2O2S

Suppliers	Catalog Number
Enamine	EN300-11830

Database	Data ID
PubChem	4961713

M. W.

262.32746

CAS

Similarity

N/A

ID: 243475

2,5-dibromothiophene-3-carbonitrile

$$$$ Data

M. F.

C5HBr2NS

Suppliers	Catalog Number
Enamine	EN300-118300

Database	Data ID
PubChem	17764639

M. W.

266.94114

CAS

Similarity

N/A

ID: 243476

4-{5H,6H,7H,8H-imidazo[1,2-a]pyrazin-7-yl}piperidine

$$$$ Data

M. F.

C11H18N4

Suppliers	Catalog Number
Enamine	EN300-118302

Database	Data ID
PubChem	63013048

M. W.

206.28742

CAS

Similarity

N/A

ID: 243477

3-methoxy-1-methyl-1H-pyrazol-4-amine

$$$$ Data

M. F.

C5H9N3O

Suppliers	Catalog Number
Enamine	EN300-118305

Database	Data ID
PubChem	45078774

M. W.

127.14446

CAS

Similarity

N/A

ID: 243478

3-(carboxymethyl)pentanedioic acid

$$$$ Data

M. F.

C7H10O6

Suppliers	Catalog Number
Enamine	EN300-118307

Database	Data ID
PubChem	62382

M. W.

190.1507

CAS

Similarity

N/A

ID: 243479

octane-1,3-diol

$$$$ Data

M. F.

C8H18O2

Suppliers	Catalog Number
Enamine	EN300-118308

Database	Data ID
PubChem	90927

M. W.

146.22732

CAS

Similarity

N/A

ID: 243480

4-aminothiane-4-carbonitrile

$$$$ Data

M. F.

C6H10N2S

Suppliers	Catalog Number
Enamine	EN300-118309

Database	Data ID
PubChem	15818740

M. W.

142.222

CAS

Similarity

N/A

ID: 243481

2-{[1-(3-methoxyphenyl)-1H-imidazol-2-yl]sulfanyl}acetic acid

$$$$ Data

M. F.

C12H12N2O3S

Suppliers	Catalog Number
Enamine	EN300-11831

Database	Data ID
PubChem	4961714

M. W.

264.30028

CAS

Similarity

N/A

ID: 243482

5-iodopyridine-3-carboxylic acid

$$$$ Data

M. F.

C6H4INO2

Suppliers	Catalog Number
Enamine	EN300-118310
Bide Pharmatech	BD104345
A&J Pharmtech	AJA-O132

Database	Data ID
PubChem	151950

M. W.

249.00593

CAS

15366-65-1

Similarity

N/A

ID: 243483

2-[N-(butan-2-yl)3-bromobenzenesulfonamido]acetic acid

$$$$ Data

M. F.

C12H16BrNO4S

Suppliers	Catalog Number
Enamine	EN300-118312

Database	Data ID
PubChem	54926110

M. W.

350.22874

CAS

Similarity

N/A

ID: 243484

3-amino-1-(morpholin-4-yl)-3-phenylpropan-1-one hydrochloride

$$$$ Data

M. F.

C13H19ClN2O2

Suppliers	Catalog Number
Enamine	EN300-118313

Database	Data ID
PubChem	67550505

M. W.

270.75516

CAS

Similarity

N/A

ID: 243485

2-amino-N-methyl-2-phenyl-N-(thiolan-3-yl)acetamide hydrochloride

$$$$ Data

M. F.

C13H19ClN2OS

Suppliers	Catalog Number
Enamine	EN300-118314

Database	Data ID
PubChem	71757261

M. W.

286.82076

CAS

Similarity

N/A

ID: 243486

(2-propoxypyridin-4-yl)methanamine dihydrochloride

$$$$ Data

M. F.

C9H16Cl2N2O

Suppliers	Catalog Number
Enamine	EN300-118315

Database	Data ID
PubChem	71757262

M. W.

239.14214

CAS

Similarity

N/A

ID: 243487

4-ethylbenzene-1-carbothioamide

$$$$ Data

M. F.

C9H11NS

Suppliers	Catalog Number
Alfa Aesar	H52265
Enamine	EN300-11832
A&J Pharmtech	AJA-O30838

Database	Data ID
PubChem	2525970

M. W.

165.25534

CAS

57774-76-2

Similarity

N/A

ID: 243488

4-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]morpholine

$$$$ Data

M. F.

C14H16N2O2S

Suppliers	Catalog Number
Enamine	EN300-118323

Database	Data ID
PubChem	4381389

M. W.

276.35404

CAS

Similarity

N/A

ID: 243489

5-methoxy-octahydro-1H-indole

$$$$ Data

M. F.

C9H17NO

Suppliers	Catalog Number
Enamine	EN300-118324

Database	Data ID
PubChem	557578

M. W.

155.23738

CAS

Similarity

N/A

ID: 243490

3-[(2-hydroxyphenyl)carbamoyl]propanoic acid

$$$$ Data

M. F.

C10H11NO4

Suppliers	Catalog Number
Enamine	EN300-11833

Database	Data ID
PubChem	774511

M. W.

209.19864

CAS

Similarity

N/A

ID: 243491

(4aR,8aR)-decahydroquinoline

$$$$ Data

M. F.

C9H17N

Suppliers	Catalog Number
Enamine	EN300-118342

Database	Data ID
PubChem	66313

M. W.

139.23798

CAS

Similarity

N/A

ID: 243492

2-methanesulfonamido-4-methylpentanoic acid

$$$$ Data

M. F.

C7H15NO4S

Suppliers	Catalog Number
Enamine	EN300-11835

Database	Data ID
PubChem	4961715

M. W.

209.2633

CAS

Similarity

N/A

ID: 243493

2-(cyclohex-1-en-1-yl)-2-methylpropanenitrile

$$$$ Data

M. F.

C10H15N

Suppliers	Catalog Number
Enamine	EN300-118356

Database	Data ID
PubChem	12389563

M. W.

149.2328

CAS

Similarity

N/A

ID: 243494

1-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-2-chloroethan-1-one

$$$$ Data

M. F.

C14H15ClN2O2

Suppliers	Catalog Number
Enamine	EN300-11836

Database	Data ID
PubChem	2525981

M. W.

278.7341

CAS

Similarity

N/A

ID: 243495

5-methyl-5-(pyridin-3-yl)imidazolidine-2,4-dione hydrochloride

$$$$ Data

M. F.

C9H10ClN3O2

Suppliers	Catalog Number
Enamine	EN300-118363

Database	Data ID
PubChem	71757263

M. W.

227.6476

CAS

Similarity

N/A

ID: 243496

(1R,3R,6R,7R)-5,8-dioxa-2-azatricyclo[4.3.0.0³,⁷]nonane

$$$$ Data

M. F.

C6H9NO2

Suppliers	Catalog Number
Enamine	EN300-118369

Database	Data ID
PubChem	55286410

M. W.

127.14116

CAS

Similarity

N/A

ID: 243497

2-bromo-6-methylpyridine-3-carboxylic acid

$$$$ Data

M. F.

C7H6BrNO2

Suppliers	Catalog Number
Enamine	EN300-118375
A&J Pharmtech	AJA-O35754

Database	Data ID
PubChem	53421336

M. W.

216.03204

CAS

1060810-09-4

Similarity

N/A

ID: 243498

3-iodoimidazo[1,2-a]pyridine-8-carbonitrile

$$$$ Data

M. F.

C8H4IN3

Suppliers	Catalog Number
Enamine	EN300-118376

Database	Data ID
PubChem	71757264

M. W.

269.04193

CAS

Similarity

N/A

ID: 243499

5-sulfamoylfuran-3-carboxylic acid

$$$$ Data

M. F.

C5H5NO5S

Suppliers	Catalog Number
Enamine	EN300-118377

Database	Data ID
PubChem	71757265

M. W.

191.1619

CAS

Similarity

N/A

ID: 243500

ethyl 2-(2-oxo-2,3-dihydro-1H-indol-1-yl)acetate

$$$$ Data

M. F.

C12H13NO3

Suppliers	Catalog Number
Enamine	EN300-118380

Database	Data ID
PubChem	300802

M. W.

219.23652

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