2-Amino-4-cyanopyridine

C₆H₅N₃CAS 42182-27-4119.13 g/mol

Open in Covalent MOL file

Nitrile Primary amine

Properties

Molecular formula: C₆H₅N₃
Molar mass: 119.13 g/mol
Exact mass: 119.0483 Da
logP: 0.54Crippen estimate
Polar surface area: 62.7 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 0

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

42182-27-4

SMILES

C1=CN=C(C=C1C#N)N

InChIKey

GEEAYLFEIFJFGP-UHFFFAOYSA-N

InChI

InChI=1S/C6H5N3/c7-4-5-1-2-9-6(8)3-5/h1-3H,(H2,8,9)

Weigh it out

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

Names and synonyms

1 names

2-Aminoisonicotinonitrile

Work with 2-Amino-4-cyanopyridine

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

2,4-Pyridinedicarbonitrile29181-50-859 % similar 2-Bromo-4-cyanopyridine10386-27-355 % similar 4-Cyano-2-methylpyridine2214-53-155 % similar 2-Chloro-4-cyanopyridine33252-30-155 % similar 4-Cyano-2-fluoropyridine3939-14-855 % similar 4-Cyanopyridine100-48-146 % similar (2-Aminopyridin-4-yl)methanol105250-17-745 % similar 3,4-Diaminobenzonitrile17626-40-345 % similar

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

Same formula

2-Amino-3-cyanopyridine24517-64-4 1H-Pyrazolo[3,4-c]pyridine271-47-6 1H-Pyrazolo[4,3-C]pyridine271-52-3 1H-Pyrazolo(3,4-b)pyridine271-73-8 Pyrrolopyrimidine272-50-4 1H-Pyrazolo(4,3-b)pyridine272-52-6 5-Azabenzimidazole272-97-9 Imidazo[4,5-b]pyridine273-21-2

Elsewhere

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