chempirical

N2-(4-Aminophenyl)-2,5-pyridinediamine

C11H12N4CAS 116735-74-1200.25 g/mol

Open in Covalent MOL file
H2NHNNNH2
Primary amineSecondary amine

Properties

Molecular formula
C11H12N4
Molar mass
200.25 g/mol
Exact mass
200.1062 Da
logP
1.99Crippen estimate
Polar surface area
77.0 Ų
H-bond donors / acceptors
3 / 4
Rotatable bonds
2

Identifiers

CAS number
116735-74-1
SMILES
C1=CC(=CC=C1N)NC2=NC=C(C=C2)N
InChIKey
MPEKLJCOZBPKRO-UHFFFAOYSA-N
InChI
InChI=1S/C11H12N4/c12-8-1-4-10(5-2-8)15-11-6-3-9(13)7-14-11/h1-7H,12-13H2,(H,14,15)

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Names and synonyms

1 names
  • N2-(4-Aminophenyl)pyridine-2,5-diamine

Work with N2-(4-Aminophenyl)-2,5-pyridinediamine

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

4-Aminodiphenylamine101-54-248 % similar 5-Amino-2-methoxypyridine6628-77-942 % similar 5-Amino-2-bromopyridine13534-97-942 % similar 6-Fluoro-3-pyridinamine1827-27-642 % similar 5-Amino-2-methylpyridine3430-14-642 % similar 5-Amino-2-chloropyridine5350-93-642 % similar Variamine blue3566-44-742 % similar 4,4′-Diaminodiphenylamine sulfate53760-27-341 % similar

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

Elsewhere

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