Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2)C[C@H](C)N1- InChIKey
UBLZWKCJZSDBGQ-AOOOYVTPSA-N- Molecular formula
- C12H17N3O2
- Average molar mass
- 235.28 g/mol
Names & identifiers
- Preferred name
- cis-3,5-Dimethyl-1-(4-nitrophenyl)piperazine
- IUPAC
- (3R,5S)-3,5-dimethyl-1-(4-nitrophenyl)piperazine
Names & synonyms
153747-81-0cis-3,5-Dimethyl-1-(4-nitrophenyl)piperazinerel-(3S,5R)-3,5-Dimethyl-1-(4-nitrophenyl)piperazine(3R,5S)-3,5-dimethyl-1-(4-nitrophenyl)piperazineSCHEMBL1044822UBLZWKCJZSDBGQ-AOOOYVTPSA-NAKOS027441477F71077Cis-3,5-dimethyl-1-(4-nitro-phenyl)-piperazine
Database identifiers
- PubChem CID
- 7059963
Properties
Computed structural propertiesFilling in
- XLogP
- 2.1
- Topological polar surface area
- 61.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 261
Related reactions
5 records
Compound notes
Loading…