1-Propanone, 1-phenyl-3-(1-piperidinyl)-2-(1-piperidinylmethyl)-
Basic information
- CAS
90548-89-3- Standard SMILES
O=C(c1ccccc1)C(CN1CCCCC1)CN1CCCCC1- InChIKey
CQDHXQRPRMXIBF-UHFFFAOYSA-N- Molecular formula
- C20H30N2O
- Average molar mass
- 314.5 g/mol
- Monoisotopic mass
- 314.23581359
Names & identifiers
- Preferred name
- 1-Propanone, 1-phenyl-3-(1-piperidinyl)-2-(1-piperidinylmethyl)-
- IUPAC
- 1-phenyl-3-piperidin-1-yl-2-(piperidin-1-ylmethyl)propan-1-one
- English name
- Benzhexol Impurity 11
- Molecular formula
- C20H30N2O
- Molecular weight
- 314.46
Names & synonyms
90548-89-31-Propanone, 1-phenyl-3-(1-piperidinyl)-2-(1-piperidinylmethyl)-1-phenyl-3-piperidin-1-yl-2-(piperidin-1-ylmethyl)propan-1-one1-PHENYL-3-(PIPERIDIN-1-YL)-2-(PIPERIDIN-1-YLMETHYL)PROPAN-1-ONEDTXSID103286011-phenyl-3-(piperidin-1-yl)-2-[(piperidin-1-yl)methyl]propan-1-oneTrihexyphenidyl(Benzhexol) Impurity 11Benzhexol ImpurityBenzhexol Impurity 11Phenylhexol impurity 6Phenylhexol impurity 10
Database identifiers
- CAS
90548-89-3- PubChem CID
- 412359
- DTXSID
DTXSID10328601- Nikkaji
- J357.848H
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 23.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 333
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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