Basic information
- Standard SMILES
N#Cc1ccc(Nc2ccccn2)c([N+](=O)[O-])c1- InChIKey
INIYRUCUYMYCRN-UHFFFAOYSA-N- Molecular formula
- C12H8N4O2
- Average molar mass
- 240.22 g/mol
Names & identifiers
- Preferred name
- 4-cyano-2-nitro-N-(2-pyridyl)aniline
- IUPAC
- 3-nitro-4-(pyridin-2-ylamino)benzonitrile
Names & synonyms
SCHEMBL6836869INIYRUCUYMYCRN-UHFFFAOYSA-N4-cyano-2-nitro-N-(2-pyridyl)aniline
Database identifiers
- PubChem CID
- 22736714
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 94.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 346
Related reactions
2 records
Compound notes
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