chempirical

3-(2-Methyl-4-pyrimidinyl)benzenamine

C11H11N3CAS 175201-90-8185.23 g/mol

Open in Covalent MOL file
NH2NN
Primary amine

Properties

Molecular formula
C11H11N3
Molar mass
185.23 g/mol
Exact mass
185.0953 Da
logP
2.03Crippen estimate
Polar surface area
51.8 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
1

Identifiers

CAS number
175201-90-8
SMILES
Cc1nccc(-c2cccc(N)c2)n1
InChIKey
DMWKPJRZFGLSAX-UHFFFAOYSA-N
InChI
InChI=1S/C11H11N3/c1-8-13-6-5-11(14-8)9-3-2-4-10(12)7-9/h2-7H,12H2,1H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

5 names
  • Benzenamine, 3-(2-methyl-4-pyrimidinyl)-
  • 4-(3-Aminophenyl)-2-methylpyrimidine
  • (3-(2-Methylpyrimidin-4-yl)phenyl)amine
  • 3-(2-Methylpyrimidin-4-yl)aniline
  • 3-(2-Methyl-4-pyrimidinyl)aniline

Work with 3-(2-Methyl-4-pyrimidinyl)benzenamine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

3-Aminobiphenyl2243-47-243 % similar 6-Methyl-N-[4-(pyridin-3-yl)pyrimidin-2-yl]benzene-1,3-diamine152460-10-142 % similar M-Toluidine108-44-139 % similar 4'-Fluoro(1,1'-biphenyl)-3-amine10540-45-138 % similar M-Phenylenediamine108-45-238 % similar 5-(3-Aminophenyl)tetrazole73732-51-137 % similar 4-Amino-2-chloropyridine14432-12-337 % similar M-Phenylenediamine hydrochloride541-69-534 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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