N-Phenyl-2-pyrimidinamine

C₁₀H₉N₃CAS 57356-49-7171.20 g/mol

Open in Covalent MOL file

Secondary amine

Properties

Molecular formula: C₁₀H₉N₃
Molar mass: 171.20 g/mol
Exact mass: 171.0796 Da
Melting point: 116 °C
logP: 2.22Crippen estimate
Polar surface area: 37.8 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 2

Identifiers

CAS number

57356-49-7

SMILES

c1ccc(Nc2ncccn2)cc1

InChIKey

XGXNTJHZPBRBHJ-UHFFFAOYSA-N

InChI

InChI=1S/C10H9N3/c1-2-5-9(6-3-1)13-10-11-7-4-8-12-10/h1-8H,(H,11,12,13)

Weigh it out

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

Names and synonyms

4 names

2-Pyrimidinamine, N-phenyl-
Pyrimidine, 2-anilino-
2-Anilinopyrimidine
2-(Phenylamino)pyrimidine

Work with N-Phenyl-2-pyrimidinamine

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

N-Phenyl-2-pyridinamine6631-37-458 % similar Diphenylamine122-39-452 % similar N,N′-Diphenyl-P-phenylenediamine74-31-750 % similar Pyrimethanil53112-28-047 % similar Diphenylammonium chloride537-67-746 % similar Diphenylbenzidine531-91-944 % similar N-Phenyl-2-pyridinemethanamine4329-81-142 % similar 4-[(4-Hydroxy-2-pyrimidinyl)amino]benzonitrile189956-45-439 % similar

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

Same formula

2,2'-Dipyridylamine1202-34-2

Elsewhere

PubChem CAS Common Chemistry NIST WebBook