Chembase list of 866358 unique molecular structures

2-[5-(trifluoromethyl)pyrimidin-2-yl]ethan-1-amine

$$$$

M. F.

C7H8F3N3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20350

Database

Data ID

M. W.

191.1537296

CAS

Similarity

N/A

ID: 803652

N-methyl-5-(trifluoromethyl)pyrimidin-2-amine

$$$$

M. F.

C6H6F3N3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20351

Database

Data ID

M. W.

177.1271496

CAS

Similarity

N/A

ID: 803653

5-chloro-N-methylpyrimidin-2-amine

$$$$

M. F.

C5H6ClN3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20352

Database

Data ID

M. W.

143.57424

CAS

45715-16-0

Similarity

N/A

ID: 803654

5-chloropyrimidine-2-carbaldehyde

$$$$

M. F.

C5H3ClN2O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20353

Database

Data ID

M. W.

142.54312

CAS

944900-20-3

Similarity

N/A

ID: 803655

5-chloro-2-(piperazin-1-yl)pyrimidine

$$$$

M. F.

C8H11ClN4

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20355

Database

Data ID

M. W.

198.65274

CAS

59215-40-6

Similarity

N/A

ID: 803656

5-chloro-2-(pyrrolidin-2-yl)pyrimidine

$$$$

M. F.

C8H10ClN3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20356

Database

Data ID

M. W.

183.6381

CAS

Similarity

N/A

ID: 803657

2-(5-chloropyrimidin-2-yl)ethan-1-amine

$$$$

M. F.

C6H8ClN3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20357

Database

Data ID

M. W.

157.60082

CAS

Similarity

N/A

ID: 803658

2-tert-butylpyrimidine-4-carbaldehyde

$$$$

M. F.

C9H12N2O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20359

Database

Data ID

M. W.

164.20438

CAS

Similarity

N/A

ID: 803659

2-(trifluoromethyl)pyrimidine-4-carbaldehyde

$$$$

M. F.

C6H3F3N2O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20360

Database

Data ID

M. W.

176.0960296

CAS

Similarity

N/A

ID: 803660

2-(piperidin-1-yl)pyrimidine-4-carbaldehyde

$$$$

M. F.

C10H13N3O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20361

Database

Data ID

M. W.

191.22972

CAS

Similarity

N/A

ID: 803661

tert-butyl 4-(4-formylpyrimidin-2-yl)piperazine-1-carboxylate

$$$$

M. F.

C14H20N4O3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20362

Database

Data ID

M. W.

292.3336

CAS

944901-19-3

Similarity

N/A

ID: 803662

2-chloropyrimidine-4-carbaldehyde

$$$$

M. F.

C5H3ClN2O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20363

Database

Data ID

M. W.

142.54312

CAS

944901-22-8

Similarity

N/A

ID: 803663

2-amino-6-methylpyrimidine-4-carbaldehyde

$$$$

M. F.

C6H7N3O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20364

Database

Data ID

M. W.

137.13928

CAS

Similarity

N/A

ID: 803664

2-methoxy-6-methylpyrimidine-4-carbaldehyde

$$$$

M. F.

C7H8N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20365

Database

Data ID

M. W.

152.15062

CAS

Similarity

N/A

ID: 803665

2,6-dimethylpyrimidine-4-carbaldehyde

$$$$

M. F.

C7H8N2O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20366

Database

Data ID

M. W.

136.15122

CAS

1074-39-1

Similarity

N/A

ID: 803666

2,6-dichloropyrimidine-4-carbaldehyde

$$$$

M. F.

C5H2Cl2N2O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20367

Database

Data ID

M. W.

176.98818

CAS

933746-24-8

Similarity

N/A

ID: 803667

benzyl N-[(4-formyl-6-methylpyrimidin-2-yl)methyl]carbamate

$$$$

M. F.

C15H15N3O3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20368

Database

Data ID

M. W.

285.2979

CAS

Similarity

N/A

ID: 803668

ethyl 2-(4-formyl-6-methylpyrimidin-2-yl)acetate

$$$$

M. F.

C10H12N2O3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20369

Database

Data ID

M. W.

208.21388

CAS

Similarity

N/A

ID: 803669

2-hydroxy-6-methylpyrimidine-4-carbaldehyde

$$$$

M. F.

C6H6N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20370

Database

Data ID

M. W.

138.12404

CAS

Similarity

N/A

ID: 803670

2-(hydroxymethyl)-6-methylpyrimidine-4-carbaldehyde

$$$$

M. F.

C7H8N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20371

Database

Data ID

M. W.

152.15062

CAS

Similarity

N/A

ID: 803671

pyrimidine-2,4-dicarbaldehyde

$$$$

M. F.

C6H4N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20372

Database

Data ID

M. W.

136.10816

CAS

Similarity

N/A

ID: 803672

methyl 2-(4-formylpyrimidin-2-yl)acetate

$$$$

M. F.

C8H8N2O3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20373

Database

Data ID

M. W.

180.16072

CAS

Similarity

N/A

ID: 803673

methyl 4-formylpyrimidine-2-carboxylate

$$$$

M. F.

C7H6N2O3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20374

Database

Data ID

M. W.

166.13414

CAS

944901-31-9

Similarity

N/A

ID: 803674

2-(hydroxymethyl)pyrimidine-4-carbaldehyde

$$$$

M. F.

C6H6N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20375

Database

Data ID

M. W.

138.12404

CAS

944900-47-4

Similarity

N/A

ID: 803675

2-(chloromethyl)pyrimidine-4-carbaldehyde

$$$$

M. F.

C6H5ClN2O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20376

Database

Data ID

M. W.

156.5697

CAS

944901-34-2

Similarity

N/A

ID: 803676

[4-(dimethoxymethyl)pyrimidin-2-yl]methanamine

$$$$

M. F.

C8H13N3O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20377

Database

Data ID

M. W.

183.20772

CAS

Similarity

N/A

ID: 803677

benzyl N-[(4-formylpyrimidin-2-yl)methyl]carbamate

$$$$

M. F.

C14H13N3O3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20378

Database

Data ID

M. W.

271.27132

CAS

Similarity

N/A

ID: 803678

2-(4-fluorophenyl)pyrimidine-4-carbaldehyde

$$$$

M. F.

C11H7FN2O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20380

Database

Data ID

M. W.

202.1844832

CAS

Similarity

N/A

ID: 803679

2-(4-methoxyphenyl)pyrimidine-4-carbaldehyde

$$$$

M. F.

C12H10N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20381

Database

Data ID

M. W.

214.22

CAS

Similarity

N/A

ID: 803680

2-(pyrrolidin-2-yl)pyrimidine-4-carbaldehyde

$$$$

M. F.

C9H11N3O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20382

Database

Data ID

M. W.

177.20314

CAS

Similarity

N/A

ID: 803681

ethyl 6-formylpyrimidine-4-carboxylate

$$$$

M. F.

C8H8N2O3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20383

Database

Data ID

M. W.

180.16072

CAS

944901-42-2

Similarity

N/A

ID: 803682

ethyl 6-(dimethoxymethyl)pyrimidine-4-carboxylate

$$$$

M. F.

C10H14N2O4

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20384

Database

Data ID

M. W.

226.22916

CAS

Similarity

N/A

ID: 803683

ethyl 6-(dimethoxymethyl)-2-methylpyrimidine-4-carboxylate

$$$$

M. F.

C11H16N2O4

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20385

Database

Data ID

M. W.

240.25574

CAS

Similarity

N/A

ID: 803684

ethyl 6-(dimethoxymethyl)-2-(propan-2-yl)pyrimidine-4-carboxylate

$$$$

M. F.

C13H20N2O4

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20386

Database

Data ID

M. W.

268.3089

CAS

Similarity

N/A

ID: 803685

ethyl 2-tert-butyl-6-(dimethoxymethyl)pyrimidine-4-carboxylate

$$$$

M. F.

C14H22N2O4

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20387

Database

Data ID

M. W.

282.33548

CAS

Similarity

N/A

ID: 803686

ethyl 6-(dimethoxymethyl)-2-methoxypyrimidine-4-carboxylate

$$$$

M. F.

C11H16N2O5

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20388

Database

Data ID

M. W.

256.25514

CAS

Similarity

N/A

ID: 803687

ethyl 6-(dimethoxymethyl)-2-(methylsulfanyl)pyrimidine-4-carboxylate

$$$$

M. F.

C11H16N2O4S

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20389

Database

Data ID

M. W.

272.32074

CAS

Similarity

N/A

ID: 803688

ethyl 2-amino-6-(dimethoxymethyl)pyrimidine-4-carboxylate

$$$$

M. F.

C10H15N3O4

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20390

Database

Data ID

M. W.

241.2438

CAS

Similarity

N/A

ID: 803689

2-[4-(dimethoxymethyl)pyrimidin-2-yl]ethan-1-amine

$$$$

M. F.

C9H15N3O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20391

Database

Data ID

M. W.

197.2343

CAS

Similarity

N/A

ID: 803690

[4-(dimethoxymethyl)pyrimidin-2-yl]methanol

$$$$

M. F.

C8H12N2O3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20392

Database

Data ID

M. W.

184.19248

CAS

944900-71-4

Similarity

N/A

ID: 803691

ethyl 2-[4-(dimethoxymethyl)pyrimidin-2-yl]acetate

$$$$

M. F.

C11H16N2O4

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20393

Database

Data ID

M. W.

240.25574

CAS

Similarity

N/A

ID: 803692

3-[4-(dimethoxymethyl)pyrimidin-2-yl]propan-1-amine

$$$$

M. F.

C10H17N3O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20394

Database

Data ID

M. W.

211.26088

CAS

Similarity

N/A

ID: 803693

ethyl 6-formyl-2-methylpyrimidine-4-carboxylate

$$$$

M. F.

C9H10N2O3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20395

Database

Data ID

M. W.

194.1873

CAS

Similarity

N/A

ID: 803694

ethyl 6-formyl-2-methoxypyrimidine-4-carboxylate

$$$$

M. F.

C9H10N2O4

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20396

Database

Data ID

M. W.

210.1867

CAS

Similarity

N/A

ID: 803695

ethyl 2-amino-6-formylpyrimidine-4-carboxylate

$$$$

M. F.

C8H9N3O3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20397

Database

Data ID

M. W.

195.17536

CAS

Similarity

N/A

ID: 803696

ethyl 6-formyl-2-(methylsulfanyl)pyrimidine-4-carboxylate

$$$$

M. F.

C9H10N2O3S

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20398

Database

Data ID

M. W.

226.2523

CAS

Similarity

N/A

ID: 803697

ethyl 2-(dimethylamino)-6-formylpyrimidine-4-carboxylate

$$$$

M. F.

C10H13N3O3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20399

Database

Data ID

M. W.

223.22852

CAS

Similarity

N/A

ID: 803698

ethyl 2-tert-butyl-6-formylpyrimidine-4-carboxylate

$$$$

M. F.

C12H16N2O3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20400

Database

Data ID

M. W.

236.26704

CAS

Similarity

N/A

ID: 803699

ethyl 6-formyl-2-phenylpyrimidine-4-carboxylate

$$$$

M. F.

C14H12N2O3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20401

Database

Data ID

M. W.

256.25668

CAS

Similarity

N/A

ID: 803700

ethyl 6-(aminomethyl)-2-methylpyrimidine-4-carboxylate

$$$$

M. F.

C9H13N3O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O20402

Database

Data ID

M. W.

195.21842

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