Chembase list of 866358 unique molecular structures

N-[6-hydroxy-1-(2-methoxyethyl)-2-oxo-6-(trifluoromethyl)-1,2,5,6-tetrahydropyri...

$$$$ Data

M. F.

C16H17F3N2O4

Suppliers	Catalog Number
Enamine	EN300-88487

Database	Data ID
PubChem	4590814

M. W.

358.3123896

CAS

Similarity

N/A

ID: 281202

6,6,6-trifluoro-5-(methylamino)-2-(phenylformamido)hexanoic acid

$$$$ Data

M. F.

C14H17F3N2O3

Suppliers	Catalog Number
Enamine	EN300-88488

Database	Data ID
PubChem	16228887

M. W.

318.2915896

CAS

Similarity

N/A

ID: 281203

1-[(5-carbamoylfuran-2-yl)sulfonyl]pyrrolidine-2-carboxylic acid

$$$$ Data

M. F.

C10H12N2O6S

Suppliers	Catalog Number
Enamine	EN300-88489

Database	Data ID
PubChem	43810951

M. W.

288.27708

CAS

Similarity

N/A

ID: 281204

5-[(2-carbamoylpyrrolidin-1-yl)sulfonyl]furan-2-carboxylic acid

$$$$ Data

M. F.

C10H12N2O6S

Suppliers	Catalog Number
Enamine	EN300-88490

Database	Data ID
PubChem	43149870

M. W.

288.27708

CAS

Similarity

N/A

ID: 281205

1-[(5-carbamoylfuran-2-yl)sulfonyl]piperidine-4-carboxylic acid

$$$$ Data

M. F.

C11H14N2O6S

Suppliers	Catalog Number
Enamine	EN300-88491

Database	Data ID
PubChem	39871699

M. W.

302.30366

CAS

Similarity

N/A

ID: 281206

1-(4-methyl-1,3-thiazol-5-yl)ethan-1-amine

$$$$ Data

M. F.

C6H10N2S

Suppliers	Catalog Number
Enamine	EN300-88492

Database	Data ID
PubChem	19829274

M. W.

142.222

CAS

Similarity

N/A

ID: 281207

1-(2-tert-butyl-4-methyl-1,3-thiazol-5-yl)ethan-1-amine

$$$$ Data

M. F.

C10H18N2S

Suppliers	Catalog Number
Enamine	EN300-88494

Database	Data ID
PubChem	43435927

M. W.

198.32832

CAS

Similarity

N/A

ID: 281208

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

$$$$ Data

M. F.

C12H15N3

Suppliers	Catalog Number
Enamine	EN300-88495

Database	Data ID
PubChem	43810952

M. W.

201.2676

CAS

Similarity

N/A

ID: 281209

ethyl 6-(3-chloropropyl)-2-methylpyrazolo[1,5-a]pyrimidine-7-carboxylate

$$$$ Data

M. F.

C13H16ClN3O2

Suppliers	Catalog Number
Enamine	EN300-88496

Database	Data ID
PubChem	39871719

M. W.

281.73804

CAS

Similarity

N/A

ID: 281210

ethyl 6-(3-bromopropyl)-2-methylpyrazolo[1,5-a]pyrimidine-7-carboxylate

$$$$ Data

M. F.

C13H16BrN3O2

Suppliers	Catalog Number
Enamine	EN300-88497

Database	Data ID
PubChem	39871720

M. W.

326.18904

CAS

Similarity

N/A

ID: 281211

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

$$$$ Data

M. F.

C7H8ClNO2S

Suppliers	Catalog Number
Enamine	EN300-88498

Database	Data ID
PubChem	21182045

M. W.

205.66192

CAS

Similarity

N/A

ID: 281212

bicyclo[3.3.1]nonane-3-carboxylic acid

$$$$ Data

M. F.

C10H16O2

Suppliers	Catalog Number
Enamine	EN300-88499

Database	Data ID
PubChem	557345

M. W.

168.23284

CAS

Similarity

N/A

ID: 281213

3-(2-hydroxyethyl)-1λ⁶-thiolane-1,1-dione

$$$$ Data

M. F.

C6H12O3S

Suppliers	Catalog Number
ChemBridge	4045010
Enamine	EN300-88500

Database	Data ID
PubChem	20622991

M. W.

164.22268

CAS

Similarity

N/A

ID: 281214

1-(ethanesulfonyl)pyrrolidine-2-carbonitrile

$$$$ Data

M. F.

C7H12N2O2S

Suppliers	Catalog Number
Enamine	EN300-88501

Database	Data ID
PubChem	43810954

M. W.

188.24738

CAS

Similarity

N/A

ID: 281215

1-(butane-1-sulfonyl)pyrrolidine-2-carbonitrile

$$$$ Data

M. F.

C9H16N2O2S

Suppliers	Catalog Number
Enamine	EN300-88502

Database	Data ID
PubChem	43810955

M. W.

216.30054

CAS

Similarity

N/A

ID: 281216

1-methanesulfonylpiperidine-2-carbonitrile

$$$$ Data

M. F.

C7H12N2O2S

Suppliers	Catalog Number
Enamine	EN300-88503

Database	Data ID
PubChem	43810956

M. W.

188.24738

CAS

Similarity

N/A

ID: 281217

1-(ethanesulfonyl)piperidine-2-carbonitrile

$$$$ Data

M. F.

C8H14N2O2S

Suppliers	Catalog Number
Enamine	EN300-88504

Database	Data ID
PubChem	43810957

M. W.

202.27396

CAS

Similarity

N/A

ID: 281218

1-(butane-1-sulfonyl)piperidine-2-carbonitrile

$$$$ Data

M. F.

C10H18N2O2S

Suppliers	Catalog Number
Enamine	EN300-88505

Database	Data ID
PubChem	43810958

M. W.

230.32712

CAS

Similarity

N/A

ID: 281219

1-methanesulfonylpiperidine-3-carbonitrile

$$$$ Data

M. F.

C7H12N2O2S

Suppliers	Catalog Number
Enamine	EN300-88506

Database	Data ID
PubChem	43810959

M. W.

188.24738

CAS

Similarity

N/A

ID: 281220

1-(ethanesulfonyl)piperidine-3-carbonitrile

$$$$ Data

M. F.

C8H14N2O2S

Suppliers	Catalog Number
Enamine	EN300-88507

Database	Data ID
PubChem	43810960

M. W.

202.27396

CAS

Similarity

N/A

ID: 281221

1-(butane-1-sulfonyl)piperidine-3-carbonitrile

$$$$ Data

M. F.

C10H18N2O2S

Suppliers	Catalog Number
Enamine	EN300-88508

Database	Data ID
PubChem	43810961

M. W.

230.32712

CAS

Similarity

N/A

ID: 281222

1-methanesulfonylpiperidine-4-carbonitrile

$$$$ Data

M. F.

C7H12N2O2S

Suppliers	Catalog Number
Enamine	EN300-88509

Database	Data ID
PubChem	22733313

M. W.

188.24738

CAS

Similarity

N/A

ID: 281223

1-(ethanesulfonyl)piperidine-4-carbonitrile

$$$$ Data

M. F.

C8H14N2O2S

Suppliers	Catalog Number
Enamine	EN300-88510

Database	Data ID
PubChem	39240504

M. W.

202.27396

CAS

Similarity

N/A

ID: 281224

1-(butane-1-sulfonyl)piperidine-4-carbonitrile

$$$$ Data

M. F.

C10H18N2O2S

Suppliers	Catalog Number
Enamine	EN300-88512

Database	Data ID
PubChem	39247834

M. W.

230.32712

CAS

Similarity

N/A

ID: 281225

4-(4-fluorophenoxymethyl)-1,3-thiazol-2-amine

$$$$ Data

M. F.

C10H9FN2OS

Suppliers	Catalog Number
Enamine	EN300-88513

Database	Data ID
PubChem	39871767

M. W.

224.2546632

CAS

Similarity

N/A

ID: 281226

3-amino-1-benzothiophene-2-carboxamide

$$$$ Data

M. F.

C9H8N2OS

Suppliers	Catalog Number
Enamine	EN300-88534

Database	Data ID
PubChem	821974

M. W.

192.23762

CAS

Similarity

N/A

ID: 281227

3-amino-1-(5-chloro-2,4-dimethoxyphenyl)urea

$$$$ Data

M. F.

C9H12ClN3O3

Suppliers	Catalog Number
Enamine	EN300-88537

Database	Data ID
PubChem	43163936

M. W.

245.66288

CAS

Similarity

N/A

ID: 281228

1-[3-(trifluoromethyl)phenyl]cyclohexane-1-carboxylic acid

$$$$ Data

M. F.

C14H15F3O2

Suppliers	Catalog Number
Enamine	EN300-88538

Database	Data ID
PubChem	28937776

M. W.

272.2629096

CAS

Similarity

N/A

ID: 281229

2-[3-methyl-1-(3-methylbutyl)-5-oxo-4,5-dihydro-1H-pyrazol-4-yl]acetic acid

$$$$ Data

M. F.

C11H18N2O3

Suppliers	Catalog Number
Enamine	EN300-88539

Database	Data ID
PubChem	54595393

M. W.

226.27222

CAS

Similarity

N/A

ID: 281230

2-amino-3-[4-(difluoromethoxy)phenyl]propanoic acid hydrochloride

$$$$ Data

M. F.

C10H12ClF2NO3

Suppliers	Catalog Number
Enamine	EN300-88540

Database	Data ID
PubChem	54595394

M. W.

267.6569864

CAS

Similarity

N/A

ID: 281231

(4-bromo-2,6-dichlorophenyl)hydrazine hydrochloride

$$$$ Data

M. F.

C6H6BrCl3N2

Suppliers	Catalog Number
Enamine	EN300-88541

Database	Data ID
PubChem	54595395

M. W.

292.38824

CAS

Similarity

N/A

ID: 281232

(4-bromo-2,6-dichlorophenyl)hydrazine

$$$$ Data

M. F.

C6H5BrCl2N2

Suppliers	Catalog Number
Enamine	EN300-88543

Database	Data ID
PubChem	3816096

M. W.

255.9273

CAS

Similarity

N/A

ID: 281233

1-[4-(dimethylamino)phenyl]piperidin-4-amine

$$$$ Data

M. F.

C13H21N3

Suppliers	Catalog Number
Enamine	EN300-88545

Database	Data ID
PubChem	43617123

M. W.

219.32594

CAS

Similarity

N/A

ID: 281234

1-(pyrrolidin-3-yl)-2,5-dihydro-1H-pyrrole

$$$$ Data

M. F.

C8H14N2

Suppliers	Catalog Number
Enamine	EN300-88547

Database	Data ID
PubChem	54595396

M. W.

138.21016

CAS

Similarity

N/A

ID: 281235

ethyl (2Z)-2-[(Z)-benzoyl]-3-ethoxyprop-2-enoate

$$$$ Data

M. F.

C14H16O4

Suppliers	Catalog Number
Enamine	EN300-88549

Database	Data ID
PubChem	5356861

M. W.

248.27444

CAS

Similarity

N/A

ID: 281236

(4S)-4-amino-5,5,5-trifluoro-4-phenylpentan-2-one

$$$$ Data

M. F.

C11H12F3NO

Suppliers	Catalog Number
Enamine	EN300-88551

Database	Data ID
PubChem	39871771

M. W.

231.2142896

CAS

Similarity

N/A

ID: 281237

(4S)-4-amino-5,5,5-trifluoro-4-(4-methylphenyl)pentan-2-one

$$$$ Data

M. F.

C12H14F3NO

Suppliers	Catalog Number
Enamine	EN300-88552

Database	Data ID
PubChem	39871773

M. W.

245.2408696

CAS

Similarity

N/A

ID: 281238

(4S)-4-amino-5,5,5-trifluoro-4-(4-fluorophenyl)pentan-2-one

$$$$ Data

M. F.

C11H11F4NO

Suppliers	Catalog Number
Enamine	EN300-88553

Database	Data ID
PubChem	24882225

M. W.

249.2047528

CAS

Similarity

N/A

ID: 281239

(4S)-4-amino-5,5,5-trifluoro-4-(4-methoxyphenyl)pentan-2-one

$$$$ Data

M. F.

C12H14F3NO2

Suppliers	Catalog Number
Enamine	EN300-88554

Database	Data ID
PubChem	39871776

M. W.

261.2402696

CAS

Similarity

N/A

ID: 281240

(4S)-4-amino-4-(3-chlorophenyl)-5,5,5-trifluoropentan-2-one

$$$$ Data

M. F.

C11H11ClF3NO

Suppliers	Catalog Number
Enamine	EN300-88555

Database	Data ID
PubChem	39871778

M. W.

265.6593496

CAS

Similarity

N/A

ID: 281241

(4R)-4-amino-5,5,5-trifluoro-4-phenylpentan-2-one

$$$$ Data

M. F.

C11H12F3NO

Suppliers	Catalog Number
Enamine	EN300-88556

Database	Data ID
PubChem	39871780

M. W.

231.2142896

CAS

Similarity

N/A

ID: 281242

(4R)-4-amino-5,5,5-trifluoro-4-(4-methylphenyl)pentan-2-one

$$$$ Data

M. F.

C12H14F3NO

Suppliers	Catalog Number
Enamine	EN300-88557

Database	Data ID
PubChem	39871783

M. W.

245.2408696

CAS

Similarity

N/A

ID: 281243

(4R)-4-amino-5,5,5-trifluoro-4-(4-fluorophenyl)pentan-2-one

$$$$ Data

M. F.

C11H11F4NO

Suppliers	Catalog Number
Enamine	EN300-88558

Database	Data ID
PubChem	39871786

M. W.

249.2047528

CAS

Similarity

N/A

ID: 281244

(4R)-4-amino-5,5,5-trifluoro-4-(4-methoxyphenyl)pentan-2-one

$$$$ Data

M. F.

C12H14F3NO2

Suppliers	Catalog Number
Enamine	EN300-88559

Database	Data ID
PubChem	39871789

M. W.

261.2402696

CAS

Similarity

N/A

ID: 281245

(4R)-4-amino-5,5,5-trifluoro-4-(3-methylphenyl)pentan-2-one

$$$$ Data

M. F.

C12H14F3NO

Suppliers	Catalog Number
Enamine	EN300-88560

Database	Data ID
PubChem	39871791

M. W.

245.2408696

CAS

Similarity

N/A

ID: 281246

3-tert-butyl 4-methyl 2,2-dimethyl-1,3-oxazolidine-3,4-dicarboxylate

$$$$ Data

M. F.

C12H21NO5

Suppliers	Catalog Number
Enamine	EN300-88561

Database	Data ID
PubChem	5138497

M. W.

259.29884

CAS

157604-46-1

Similarity

N/A

ID: 281247

tert-butyl 4-(hydroxymethyl)-2,2-dimethyl-1,3-oxazolidine-3-carboxylate

$$$$ Data

M. F.

C11H21NO4

Suppliers	Catalog Number
Enamine	EN300-88562

Database	Data ID
PubChem	14409442

M. W.

231.28874

CAS

Similarity

N/A

ID: 281248

tert-butyl 4-(iodomethyl)-2,2-dimethyl-1,3-oxazolidine-3-carboxylate

$$$$ Data

M. F.

C11H20INO3

Suppliers	Catalog Number
Enamine	EN300-88563

Database	Data ID
PubChem	43810962

M. W.

341.18587

CAS

Similarity

N/A

ID: 281249

methyl 2-{[(tert-butoxy)carbonyl]amino}-3-hydroxybutanoate

$$$$ Data

M. F.

C10H19NO5

Suppliers	Catalog Number
Enamine	EN300-88564

Database	Data ID
PubChem	4351132

M. W.

233.26156

CAS

Similarity

N/A

ID: 281250

3-tert-butyl 4-methyl 2,2,5-trimethyl-1,3-oxazolidine-3,4-dicarboxylate

$$$$ Data

M. F.

C13H23NO5

Suppliers	Catalog Number
Enamine	EN300-88565

Database	Data ID
PubChem	43810963

M. W.

273.32542

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