Basic information
- CAS
4177-34-8- Standard SMILES
O=C1C2CCCC1C(N1CCN(c3ccccc3)CC1)CC2- InChIKey
UWHFQUNBQINORU-UHFFFAOYSA-N- Molecular formula
- C19H26N2O
- Average molar mass
- 298.4 g/mol
- Monoisotopic mass
- 298.20451346
Names & identifiers
- Preferred name
- 2-(4-Phenylpiperazin-1-yl)bicyclo(3.3.1)nonan-9-one
- IUPAC
- 2-(4-phenylpiperazin-1-yl)bicyclo[3.3.1]nonan-9-one
Names & synonyms
4177-34-8DTXSID509619752-(4-Phenylpiperazin-1-yl)bicyclo(3.3.1)nonan-9-one2-(4-Phenylpiperazin-1-yl)bicyclo[3.3.1]nonan-9-oneRefChem:1061340DTXCID301389789BICYCLO(3.3.1)NONAN-9-ONE, 2-(4-PHENYL-1-PIPERAZINYL)-, exo-endo-2-(4-Phenyl-1-piperazinyl)bicyclo(3.3.1)nonan-9-oneexo-2-(4-Phenyl-1-piperazinyl)bicyclo(3.3.1)nonan-9-oneBICYCLO(3.3.1)NONAN-9-ONE, 2-(4-PHENYL-1-PIPERAZINYL)-, endo-4235-18-1
Database identifiers
- CAS
4177-34-8、4235-18-1- PubChem CID
- 20145
- DTXSID
DTXSID50961975
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 23.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 396
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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