Chembase list of 866358 unique molecular structures

ethyl 5-[(1S)-1-amino-2,2,2-trifluoroethyl]furan-2-carboxylate

$$$$

M. F.

C9H10F3NO3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25083

Database

Data ID

M. W.

237.1758096

CAS

Similarity

N/A

ID: 807152

ethyl 5-[(1R)-1-amino-2,2,2-trifluoroethyl]furan-2-carboxylate

$$$$

M. F.

C9H10F3NO3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25084

Database

Data ID

M. W.

237.1758096

CAS

Similarity

N/A

ID: 807153

(1S)-2,2,2-trifluoro-1-(furan-2-yl)ethan-1-amine

$$$$

M. F.

C6H6F3NO

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25085

Database

Data ID

M. W.

165.1131496

CAS

Similarity

N/A

ID: 807154

ethyl 2,6-dimethyl-4-(trifluoromethyl)pyridine-3-carboxylate

$$$$

M. F.

C11H12F3NO2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25087

Database

Data ID

M. W.

247.2136896

CAS

Similarity

N/A

ID: 807155

2,6-dimethyl-4-(trifluoromethyl)pyridine-3-carboxylic acid

$$$$

M. F.

C9H8F3NO2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25088

Database

Data ID

M. W.

219.1605296

CAS

Similarity

N/A

ID: 807156

[2,6-dimethyl-4-(trifluoromethyl)pyridin-3-yl]methanamine

$$$$

M. F.

C9H11F3N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25089

Database

Data ID

M. W.

204.1922496

CAS

Similarity

N/A

ID: 807157

2,6-dimethyl-4-(trifluoromethyl)pyridine-3-carbaldehyde

$$$$

M. F.

C9H8F3NO

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25090

Database

Data ID

M. W.

203.1611296

CAS

Similarity

N/A

ID: 807158

(3-methoxypyridin-2-yl)methanamine

$$$$

M. F.

C7H10N2O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25094

Database

Data ID

M. W.

138.1671

CAS

595560-87-5

Similarity

N/A

ID: 807159

2-chloro-3-methoxy-6-nitropyridine

$$$$

M. F.

C6H5ClN2O3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25095

Database

Data ID

M. W.

188.5685

CAS

886371-75-1

Similarity

N/A

ID: 807160

6-chloro-5-methoxypyridin-2-amine

$$$$

M. F.

C6H7ClN2O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25096

Database

Data ID

M. W.

158.58558

CAS

886371-76-2

Similarity

N/A

ID: 807161

6-(trifluoromethoxy)pyridin-3-amine

$$$$

M. F.

C6H5F3N2O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25097

Database

Data ID

M. W.

178.1119096

CAS

135900-33-3

Similarity

N/A

ID: 807162

5-nitro-2-(propan-2-yloxy)pyridine

$$$$

M. F.

C8H10N2O3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25098

Database

Data ID

M. W.

182.1766

CAS

24903-85-3

Similarity

N/A

ID: 807163

(5-aminopyridin-3-yl)boronic acid

$$$$

M. F.

C5H7BN2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25101

Database

Data ID

M. W.

137.93228

CAS

1169748-84-8

Similarity

N/A

ID: 807164

[5-(acetamidomethyl)pyridin-3-yl]boronic acid

$$$$

M. F.

C8H11BN2O3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25102

Database

Data ID

M. W.

193.99554

CAS

Similarity

N/A

ID: 807165

[5-({[(tert-butoxy)carbonyl]amino}methyl)pyridin-3-yl]boronic acid

$$$$

M. F.

C11H17BN2O4

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25103

Database

Data ID

M. W.

252.07468

CAS

Similarity

N/A

ID: 807166

(5-formylpyridin-3-yl)boronic acid

$$$$

M. F.

C6H6BNO3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25104

Database

Data ID

M. W.

150.92774

CAS

919347-69-6

Similarity

N/A

ID: 807167

[2-(2-methylpropoxy)pyridin-3-yl]boronic acid

$$$$

M. F.

C9H14BNO3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25106

Database

Data ID

M. W.

195.02336

CAS

1218790-95-4

Similarity

N/A

ID: 807168

[6-(trifluoromethoxy)pyridin-3-yl]boronic acid

$$$$

M. F.

C6H5BF3NO3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25108

Database

Data ID

M. W.

206.9150096

CAS

1008140-70-2

Similarity

N/A

ID: 807169

5-bromo-2-(trifluoromethoxy)pyridine

$$$$

M. F.

C6H3BrF3NO

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25109

Database

Data ID

M. W.

241.9933296

CAS

886371-77-3

Similarity

N/A

ID: 807170

5-bromo-2-(2,2,2-trifluoroethoxy)pyridine

$$$$

M. F.

C7H5BrF3NO

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25110

Database

Data ID

M. W.

256.0199096

CAS

126728-58-3

Similarity

N/A

ID: 807171

(6-propanoylpyridin-3-yl)boronic acid

$$$$

M. F.

C8H10BNO3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25111

Database

Data ID

M. W.

178.9809

CAS

Similarity

N/A

ID: 807172

(6-acetylpyridin-3-yl)boronic acid

$$$$

M. F.

C7H8BNO3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25112

Database

Data ID

M. W.

164.95432

CAS

Similarity

N/A

ID: 807173

4-nitropyridine-2-carbaldehyde

$$$$

M. F.

C6H4N2O3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25114

Database

Data ID

M. W.

152.10756

CAS

108338-19-8

Similarity

N/A

ID: 807174

methyl 4-fluoropyridine-2-carboxylate

$$$$

M. F.

C7H6FNO2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25116

Database

Data ID

M. W.

155.1264432

CAS

886371-79-5

Similarity

N/A

ID: 807175

tert-butyl N-[(4-aminopyridin-2-yl)methyl]carbamate

$$$$

M. F.

C11H17N3O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25117

Database

Data ID

M. W.

223.27158

CAS

886371-80-8

Similarity

N/A

ID: 807176

2-[(methylamino)methyl]pyridin-4-amine

$$$$

M. F.

C7H11N3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25118

Database

Data ID

M. W.

137.18234

CAS

Similarity

N/A

ID: 807177

methyl[(4-nitropyridin-2-yl)methyl]amine

$$$$

M. F.

C7H9N3O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25119

Database

Data ID

M. W.

167.16526

CAS

886371-83-1

Similarity

N/A

ID: 807178

2-(4-nitropyridin-2-yl)acetonitrile

$$$$

M. F.

C7H5N3O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25120

Database

Data ID

M. W.

163.1335

CAS

415912-71-9

Similarity

N/A

ID: 807179

[(4-chloropyridin-2-yl)methyl](methyl)amine

$$$$

M. F.

C7H9ClN2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25123

Database

Data ID

M. W.

156.61276

CAS

Similarity

N/A

ID: 807180

[(4-bromopyridin-2-yl)methyl](methyl)amine

$$$$

M. F.

C7H9BrN2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25124

Database

Data ID

M. W.

201.06376

CAS

886371-85-3

Similarity

N/A

ID: 807181

tert-butyl N-(5-bromo-2-methylpyridin-4-yl)carbamate

$$$$

M. F.

C11H15BrN2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25126

Database

Data ID

M. W.

287.153

CAS

886371-87-5

Similarity

N/A

ID: 807182

tert-butyl N-(5-chloro-2-methylpyridin-4-yl)carbamate

$$$$

M. F.

C11H15ClN2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25127

Database

Data ID

M. W.

242.702

CAS

Similarity

N/A

ID: 807183

(4-amino-6-methylpyridin-3-yl)boronic acid

$$$$

M. F.

C6H9BN2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25128

Database

Data ID

M. W.

151.95886

CAS

Similarity

N/A

ID: 807184

4-{[(tert-butoxy)carbonyl]amino}-6-methylpyridine-3-carboxylic acid

$$$$

M. F.

C12H16N2O4

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25129

Database

Data ID

M. W.

252.26644

CAS

Similarity

N/A

ID: 807185

tert-butyl N-(5-formyl-2-methylpyridin-4-yl)carbamate

$$$$

M. F.

C12H16N2O3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25130

Database

Data ID

M. W.

236.26704

CAS

Similarity

N/A

ID: 807186

tert-butyl N-(5-cyano-2-methylpyridin-4-yl)carbamate

$$$$

M. F.

C12H15N3O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25131

Database

Data ID

M. W.

233.2664

CAS

Similarity

N/A

ID: 807187

4-amino-6-methylpyridine-3-carbonitrile

$$$$

M. F.

C7H7N3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25132

Database

Data ID

M. W.

133.15058

CAS

Similarity

N/A

ID: 807188

methyl 4-bromo-6-methylpyridine-3-carboxylate

$$$$

M. F.

C8H8BrNO2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25133

Database

Data ID

M. W.

230.05862

CAS

886372-03-8

Similarity

N/A

ID: 807189

4-chloro-3-methylpyridine-2-carbonitrile

$$$$

M. F.

C7H5ClN2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25135

Database

Data ID

M. W.

152.581

CAS

Similarity

N/A

ID: 807190

(4-chloro-3-methylpyridin-2-yl)methanamine

$$$$

M. F.

C7H9ClN2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25136

Database

Data ID

M. W.

156.61276

CAS

Similarity

N/A

ID: 807191

4-chloro-3-methylpyridine-2-carbaldehyde

$$$$

M. F.

C7H6ClNO

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25137

Database

Data ID

M. W.

155.58164

CAS

Similarity

N/A

ID: 807192

4-bromo-3-methylpyridine-2-carbonitrile

$$$$

M. F.

C7H5BrN2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25138

Database

Data ID

M. W.

197.032

CAS

Similarity

N/A

ID: 807193

(4-bromo-3-methylpyridin-2-yl)methanamine

$$$$

M. F.

C7H9BrN2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25139

Database

Data ID

M. W.

201.06376

CAS

Similarity

N/A

ID: 807194

4-bromo-3-methylpyridine-2-carbaldehyde

$$$$

M. F.

C7H6BrNO

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25140

Database

Data ID

M. W.

200.03264

CAS

Similarity

N/A

ID: 807195

3-methyl-4-nitropyridine-2-carbonitrile

$$$$

M. F.

C7H5N3O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25141

Database

Data ID

M. W.

163.1335

CAS

30235-13-3

Similarity

N/A

ID: 807196

(3-methyl-4-nitropyridin-2-yl)methanamine

$$$$

M. F.

C7H9N3O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25142

Database

Data ID

M. W.

167.16526

CAS

Similarity

N/A

ID: 807197

(4-methoxy-3-methylpyridin-2-yl)methanamine

$$$$

M. F.

C8H12N2O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25143

Database

Data ID

M. W.

152.19368

CAS

Similarity

N/A

ID: 807198

4-methoxy-3-methylpyridine-2-carbonitrile

$$$$

M. F.

C8H8N2O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25144

Database

Data ID

M. W.

148.16192

CAS

Similarity

N/A

ID: 807199

4-methoxy-3-methylpyridine-2-carbaldehyde

$$$$

M. F.

C8H9NO2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25145

Database

Data ID

M. W.

151.16256

CAS

Similarity

N/A

ID: 807200

4-ethoxy-3-methylpyridine-2-carbonitrile

$$$$

M. F.

C9H10N2O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O25146

Database

Data ID

M. W.

162.1885

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