Chembase list of 866358 unique molecular structures

tert-butyl 4-(hydroxymethyl)-2,2,5-trimethyl-1,3-oxazolidine-3-carboxylate

$$$$ Data

M. F.

C12H23NO4

Suppliers	Catalog Number
Enamine	EN300-88566

Database	Data ID
PubChem	43810964

M. W.

245.31532

CAS

Similarity

N/A

ID: 281252

tert-butyl 4-(iodomethyl)-2,2,5-trimethyl-1,3-oxazolidine-3-carboxylate

$$$$ Data

M. F.

C12H22INO3

Suppliers	Catalog Number
Enamine	EN300-88567

Database	Data ID
PubChem	43810965

M. W.

355.21245

CAS

Similarity

N/A

ID: 281253

1-(bromomethyl)-4-tert-butylcyclohexane

$$$$ Data

M. F.

C11H21Br

Suppliers	Catalog Number
Enamine	EN300-88569

Database	Data ID
PubChem	13175542

M. W.

233.18844

CAS

Similarity

N/A

ID: 281254

4-(iodomethyl)-2,2-dimethyl-1,3-dioxolane

$$$$ Data

M. F.

C6H11IO2

Suppliers	Catalog Number
Enamine	EN300-88570

Database	Data ID
PubChem	11139278

M. W.

242.05481

CAS

4351-11-5

Similarity

N/A

ID: 281255

4-(2-iodoethyl)-2,2-dimethyl-1,3-dioxolane

$$$$ Data

M. F.

C7H13IO2

Suppliers	Catalog Number
Enamine	EN300-88571

Database	Data ID
PubChem	13433456

M. W.

256.08139

CAS

Similarity

N/A

ID: 281256

3-ethyl-3-azabicyclo[3.2.1]octan-8-ol

$$$$ Data

M. F.

C9H17NO

Suppliers	Catalog Number
Enamine	EN300-88572

Database	Data ID
PubChem	43810966

M. W.

155.23738

CAS

Similarity

N/A

ID: 281257

3-ethyl-3-azabicyclo[3.2.1]octan-8-one

$$$$ Data

M. F.

C9H15NO

Suppliers	Catalog Number
Enamine	EN300-88573

Database	Data ID
PubChem	43810967

M. W.

153.2215

CAS

Similarity

N/A

ID: 281258

3-ethyl-3-azabicyclo[3.2.1]octan-8-amine

$$$$ Data

M. F.

C9H18N2

Suppliers	Catalog Number
Enamine	EN300-88574

Database	Data ID
PubChem	43810968

M. W.

154.25262

CAS

Similarity

N/A

ID: 281259

3-(propan-2-yl)-3-azabicyclo[3.2.1]octan-8-ol

$$$$ Data

M. F.

C10H19NO

Suppliers	Catalog Number
Enamine	EN300-88575

Database	Data ID
PubChem	43810969

M. W.

169.26396

CAS

Similarity

N/A

ID: 281260

3-propyl-3-azabicyclo[3.2.1]octan-8-ol

$$$$ Data

M. F.

C10H19NO

Suppliers	Catalog Number
Enamine	EN300-88577

Database	Data ID
PubChem	43810971

M. W.

169.26396

CAS

Similarity

N/A

ID: 281261

3-propyl-3-azabicyclo[3.2.1]octan-8-one

$$$$ Data

M. F.

C10H17NO

Suppliers	Catalog Number
Enamine	EN300-88578

Database	Data ID
PubChem	43810972

M. W.

167.24808

CAS

Similarity

N/A

ID: 281262

3-cyclopropyl-3-azabicyclo[3.2.1]octan-8-ol

$$$$ Data

M. F.

C10H17NO

Suppliers	Catalog Number
Enamine	EN300-88580

Database	Data ID
PubChem	43810974

M. W.

167.24808

CAS

Similarity

N/A

ID: 281263

3-cyclopropyl-3-azabicyclo[3.2.1]octan-8-one

$$$$ Data

M. F.

C10H15NO

Suppliers	Catalog Number
Enamine	EN300-88581

Database	Data ID
PubChem	43810975

M. W.

165.2322

CAS

Similarity

N/A

ID: 281264

3-tert-butyl-3-azabicyclo[3.2.1]octan-8-ol

$$$$ Data

M. F.

C11H21NO

Suppliers	Catalog Number
Enamine	EN300-88583

Database	Data ID
PubChem	43810977

M. W.

183.29054

CAS

Similarity

N/A

ID: 281265

3-ethyl-3-azabicyclo[3.3.1]nonan-9-ol

$$$$ Data

M. F.

C10H19NO

Suppliers	Catalog Number
Enamine	EN300-88584

Database	Data ID
PubChem	43810979

M. W.

169.26396

CAS

Similarity

N/A

ID: 281266

3-ethyl-3-azabicyclo[3.3.1]nonan-9-one

$$$$ Data

M. F.

C10H17NO

Suppliers	Catalog Number
Enamine	EN300-88585

Database	Data ID
PubChem	21855736

M. W.

167.24808

CAS

Similarity

N/A

ID: 281267

3-ethyl-3-azabicyclo[3.3.1]nonan-9-amine

$$$$ Data

M. F.

C10H20N2

Suppliers	Catalog Number
Enamine	EN300-88586

Database	Data ID
PubChem	43810980

M. W.

168.2792

CAS

Similarity

N/A

ID: 281268

3-cyclopropyl-3-azabicyclo[3.3.1]nonan-9-ol

$$$$ Data

M. F.

C11H19NO

Suppliers	Catalog Number
Enamine	EN300-88587

Database	Data ID
PubChem	43810982

M. W.

181.27466

CAS

Similarity

N/A

ID: 281269

3-propyl-3-azabicyclo[3.3.1]nonan-9-ol

$$$$ Data

M. F.

C11H21NO

Suppliers	Catalog Number
Enamine	EN300-88588

Database	Data ID
PubChem	43810984

M. W.

183.29054

CAS

Similarity

N/A

ID: 281270

3-propyl-3-azabicyclo[3.3.1]nonan-9-one

$$$$ Data

M. F.

C11H19NO

Suppliers	Catalog Number
Enamine	EN300-88589

Database	Data ID
PubChem	21855738

M. W.

181.27466

CAS

Similarity

N/A

ID: 281271

3-propyl-3-azabicyclo[3.3.1]nonan-9-amine

$$$$ Data

M. F.

C11H22N2

Suppliers	Catalog Number
Enamine	EN300-88590

Database	Data ID
PubChem	43810985

M. W.

182.30578

CAS

Similarity

N/A

ID: 281272

3-fluoro-4-(2-fluorophenoxy)benzonitrile

$$$$ Data

M. F.

C13H7F2NO

Suppliers	Catalog Number
Enamine	EN300-88596

Database	Data ID
PubChem	43657441

M. W.

231.1975864

CAS

Similarity

N/A

ID: 281273

3-tert-butyl-3-azabicyclo[3.3.1]nonan-9-ol

$$$$ Data

M. F.

C12H23NO

Suppliers	Catalog Number
Enamine	EN300-88597

Database	Data ID
PubChem	43810986

M. W.

197.31712

CAS

Similarity

N/A

ID: 281274

3-tert-butyl-3-azabicyclo[3.3.1]nonan-9-one

$$$$ Data

M. F.

C12H21NO

Suppliers	Catalog Number
Enamine	EN300-88598

Database	Data ID
PubChem	43810987

M. W.

195.30124

CAS

Similarity

N/A

ID: 281275

3-tert-butyl-3-azabicyclo[3.3.1]nonan-9-amine

$$$$ Data

M. F.

C12H24N2

Suppliers	Catalog Number
Enamine	EN300-88599

Database	Data ID
PubChem	43810988

M. W.

196.33236

CAS

Similarity

N/A

ID: 281276

3-amino-1-ethyl-6-(trifluoromethyl)-1,2-dihydropyridin-2-one

$$$$ Data

M. F.

C8H9F3N2O

Suppliers	Catalog Number
Enamine	EN300-88600

Database	Data ID
PubChem	39871946

M. W.

206.1650696

CAS

Similarity

N/A

ID: 281277

5-(chloromethyl)-2-methoxybenzonitrile

$$$$ Data

M. F.

C9H8ClNO

Suppliers	Catalog Number
Enamine	EN300-88601

Database	Data ID
PubChem	22996191

M. W.

181.61892

CAS

Similarity

N/A

ID: 281278

3-amino-1-propyl-6-(trifluoromethyl)-1,2-dihydropyridin-2-one

$$$$ Data

M. F.

C9H11F3N2O

Suppliers	Catalog Number
Enamine	EN300-88602

Database	Data ID
PubChem	39871949

M. W.

220.1916496

CAS

Similarity

N/A

ID: 281279

3-amino-1-cyclopropyl-6-(trifluoromethyl)-1,2-dihydropyridin-2-one

$$$$ Data

M. F.

C9H9F3N2O

Suppliers	Catalog Number
Enamine	EN300-88603

Database	Data ID
PubChem	39871952

M. W.

218.1757696

CAS

Similarity

N/A

ID: 281280

4-(8-chloro-2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrrole-3-carboxylic acid

$$$$ Data

M. F.

C13H10ClNO4

Suppliers	Catalog Number
Enamine	EN300-88604

Database	Data ID
PubChem	43316689

M. W.

279.6758

CAS

Similarity

N/A

ID: 281281

3-amino-1-butyl-6-(trifluoromethyl)-1,2-dihydropyridin-2-one

$$$$ Data

M. F.

C10H13F3N2O

Suppliers	Catalog Number
Enamine	EN300-88605

Database	Data ID
PubChem	39871955

M. W.

234.2182296

CAS

Similarity

N/A

ID: 281282

4-(4-nitro-1H-pyrazol-3-yl)pyridine

$$$$ Data

M. F.

C8H6N4O2

Suppliers	Catalog Number
Enamine	EN300-88606

Database	Data ID
PubChem	54595397

M. W.

190.15884

CAS

Similarity

N/A

ID: 281283

5-oxo-octahydro-2H-[1,3]thiazolo[2,3-?]indole-3-carboxylic acid

$$$$ Data

M. F.

C11H15NO3S

Suppliers	Catalog Number
Enamine	EN300-88607

Database	Data ID
PubChem	42960579

M. W.

241.3067

CAS

Similarity

N/A

ID: 281284

2,2,4-trimethyl-1,2,3,4-tetrahydroquinoline

$$$$ Data

M. F.

C12H17N

Suppliers	Catalog Number
Enamine	EN300-88608
A&J Pharmtech	AJA-O9981

Database	Data ID
PubChem	107292

M. W.

175.27008

CAS

4497-58-9

Similarity

N/A

ID: 281285

2-iodo-3-methylaniline

$$$$ Data

M. F.

C7H8IN

Suppliers	Catalog Number
Enamine	EN300-88612

Database	Data ID
PubChem	20077496

M. W.

233.04959

CAS

89938-16-9

Similarity

N/A

ID: 281286

2-chloro-5-iodoaniline

$$$$ Data

M. F.

C6H5ClIN

Suppliers	Catalog Number
Enamine	EN300-88616
A&J Pharmtech	AJA-O19268

Database	Data ID
PubChem	39871971

M. W.

253.46807

CAS

16604-98-1

Similarity

N/A

ID: 281287

4-methyl-3-(piperidin-4-yl)-1H-indole

$$$$ Data

M. F.

C14H18N2

Suppliers	Catalog Number
Enamine	EN300-88617

Database	Data ID
PubChem	39871974

M. W.

214.30612

CAS

Similarity

N/A

ID: 281288

3-chloro-2-methanesulfonylaniline

$$$$ Data

M. F.

C7H8ClNO2S

Suppliers	Catalog Number
Enamine	EN300-88618

Database	Data ID
PubChem	24698315

M. W.

205.66192

CAS

Similarity

N/A

ID: 281289

2-[(2,2,2-trifluoroethyl)amino]acetic acid

$$$$ Data

M. F.

C4H6F3NO2

Suppliers	Catalog Number
Enamine	EN300-88619

Database	Data ID
PubChem	28897662

M. W.

157.0911496

CAS

Similarity

N/A

ID: 281290

tert-butyl 2,3,4,5-tetrahydro-1H-1,4-benzodiazepine-1-carboxylate

$$$$ Data

M. F.

C14H20N2O2

Suppliers	Catalog Number
Enamine	EN300-88620

Database	Data ID
PubChem	39871977

M. W.

248.3208

CAS

Similarity

N/A

ID: 281291

3-oxa-9-azaspiro[5.5]undecane

$$$$ Data

M. F.

C9H17NO

Suppliers	Catalog Number
ChemBridge	4038196
Enamine	EN300-88621

Database	Data ID
PubChem	39871984

M. W.

155.23738

CAS

311-21-7

Similarity

N/A

ID: 281292

2-(2-benzyl-2H-1,2,3-triazol-4-yl)acetic acid

$$$$ Data

M. F.

C11H11N3O2

Suppliers	Catalog Number
Enamine	EN300-88622

Database	Data ID
PubChem	39871988

M. W.

217.22394

CAS

Similarity

N/A

ID: 281293

3-ethyl-2-(morpholin-4-yl)pentanoic acid hydrochloride

$$$$ Data

M. F.

C11H22ClNO3

Suppliers	Catalog Number
Enamine	EN300-88623

Database	Data ID
PubChem	54595398

M. W.

251.75028

CAS

Similarity

N/A

ID: 281294

2-(cyclopentyloxy)pyridine-3-carboxylic acid

$$$$ Data

M. F.

C11H13NO3

Suppliers	Catalog Number
Enamine	EN300-88625

Database	Data ID
PubChem	16784517

M. W.

207.22582

CAS

953732-05-3

Similarity

N/A

ID: 281295

4-(propan-2-yloxy)benzene-1-carboximidamide hydrochloride

$$$$ Data

M. F.

C10H15ClN2O

Suppliers	Catalog Number
Enamine	EN300-88626

Database	Data ID
PubChem	14400648

M. W.

214.6919

CAS

Similarity

N/A

ID: 281296

4-chlorobenzo[g]quinazoline

$$$$ Data

M. F.

C12H7ClN2

Suppliers	Catalog Number
Enamine	EN300-88628

Database	Data ID
PubChem	11063805

M. W.

214.65038

CAS

Similarity

N/A

ID: 281297

3-[(4-aminophenyl)formamido]propanamide

$$$$ Data

M. F.

C10H13N3O2

Suppliers	Catalog Number
Enamine	EN300-88629

Database	Data ID
PubChem	39871995

M. W.

207.22912

CAS

Similarity

N/A

ID: 281298

3-{[(3-methylphenyl)methyl]amino}propanamide

$$$$ Data

M. F.

C11H16N2O

Suppliers	Catalog Number
Enamine	EN300-88630

Database	Data ID
PubChem	39871998

M. W.

192.25754

CAS

Similarity

N/A

ID: 281299

methyl 3-{[(3-methylphenyl)methyl]amino}propanoate

$$$$ Data

M. F.

C12H17NO2

Suppliers	Catalog Number
Enamine	EN300-88631

Database	Data ID
PubChem	39872002

M. W.

207.26888

CAS

Similarity

N/A

ID: 281300

[2-(pyridin-2-yl)-1,3-thiazol-4-yl]methanamine

$$$$ Data

M. F.

C9H9N3S

Suppliers	Catalog Number
Enamine	EN300-88632

Database	Data ID
PubChem	24252948

M. W.

191.25286

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