chempirical

4-(Pyridin-3-yl)pyrimidin-2-amine

C9H8N4CAS 66521-66-2172.19 g/mol

Open in Covalent MOL file
NNNNH2
Primary amine

Properties

Molecular formula
C9H8N4
Molar mass
172.19 g/mol
Exact mass
172.0749 Da
logP
1.12Crippen estimate
Polar surface area
64.7 Ų
H-bond donors / acceptors
1 / 4
Rotatable bonds
1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
66521-66-2
SMILES
C1=CC(=CN=C1)C2=NC(=NC=C2)N
InChIKey
LQHQKYWYKPLKCH-UHFFFAOYSA-N
InChI
InChI=1S/C9H8N4/c10-9-12-5-3-8(13-9)7-2-1-4-11-6-7/h1-6H,(H2,10,12,13)

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Names and synonyms

1 names
  • 4-(3-Pyridinyl)-2-aminopyrimidine

Work with 4-(Pyridin-3-yl)pyrimidin-2-amine

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

6-Methyl-N-[4-(pyridin-3-yl)pyrimidin-2-yl]benzene-1,3-diamine152460-10-150 % similar 2,3′-Bipyridine581-50-050 % similar 4-(Pyridin-3-yl)aniline82261-42-550 % similar 3-Phenylpyridine1008-88-444 % similar Pyridine, 3-(1H-1,2,3-triazol-4-yl)- (9ci)120241-79-443 % similar 1,3,5-Tri(m-pyrid-3-ylphenyl)benzene921205-03-041 % similar 2-Amino-4-bromopyrimidine343926-69-240 % similar 2-Amino-4-chloropyrimidine3993-78-040 % similar

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

Elsewhere

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