Basic information
- Standard SMILES
CC1CN(c2ccccc2[N+](=O)[O-])CCN1CCCN- InChIKey
QNFNHWSMZXNZEO-UHFFFAOYSA-N- Molecular formula
- C14H22N4O2
- Average molar mass
- 278.35 g/mol
Names & identifiers
- Preferred name
- 3-[2-Methyl-4-(2-nitrophenyl)piperazin-1-yl]propan-1-amine
- IUPAC
- 3-[2-methyl-4-(2-nitrophenyl)piperazin-1-yl]propan-1-amine
Names & synonyms
SCHEMBL6969344
Database identifiers
- PubChem CID
- 22993454
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 78.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 321
Related reactions
1 records
Compound notes
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