Basic information
- Standard SMILES
CN1C2CCC1CN(c1ccc3cc([N+](=O)[O-])ccc3n1)C2- InChIKey
DWPCAHFGQXMJLK-UHFFFAOYSA-N- Molecular formula
- C16H18N4O2
- Average molar mass
- 298.34 g/mol
Names & identifiers
- Preferred name
- 2-(8-Methyl-3,8-diaza-bicyclo[3.2.1]oct-3-yl)-6-nitro-quinoline
- IUPAC
- 2-(8-methyl-3,8-diazabicyclo[3.2.1]octan-3-yl)-6-nitroquinoline
Names & synonyms
SCHEMBL3540666DWPCAHFGQXMJLK-UHFFFAOYSA-N2-(8-Methyl-3,8-diaza-bicyclo[3.2.1]oct-3-yl)-6-nitro-quinoline
Database identifiers
- PubChem CID
- 11950591
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 65.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 426
Related reactions
2 records
Compound notes
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