Basic information
- Standard SMILES
O=[N+]([O-])c1ccccc1/C=C/CNCCNc1ccncc1- InChIKey
MVBGHMYGKWBVJG-HWKANZROSA-N- Molecular formula
- C16H18N4O2
- Average molar mass
- 298.34 g/mol
Names & identifiers
- Preferred name
- (E)-N-(2-nitrocinnamyl)-N'-(4-pyridyl)ethylenediamine
- IUPAC
- N-[(E)-3-(2-nitrophenyl)prop-2-enyl]-N'-pyridin-4-ylethane-1,2-diamine
Names & synonyms
SCHEMBL9677255MVBGHMYGKWBVJG-HWKANZROSA-N(E)-N-(2-nitrocinnamyl)-N'-(4-pyridyl)ethyenediamine(E)-N-(2-nitrocinnamyl)-N'-(4-pyridyl)ethylenediamine
Database identifiers
- PubChem CID
- 14834211
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 82.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 351
Related reactions
2 records
Compound notes
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