3-(4-Methoxyphenyl)-1-phenyl-3-(piperidin-1-yl)propan-1-one--hydrogen chloride (1/1)
Basic information
- CAS
24210-96-6- Standard SMILES
COc1ccc(C(CC(=O)c2ccccc2)N2CCCCC2)cc1.Cl- InChIKey
GNYKORXUSBCNSG-UHFFFAOYSA-N- Molecular formula
- C21H26ClNO2
- Average molar mass
- 359.9 g/mol
- Monoisotopic mass
- 359.1652068
Names & identifiers
- Preferred name
- 3-(4-Methoxyphenyl)-1-phenyl-3-(piperidin-1-yl)propan-1-one--hydrogen chloride (1/1)
- IUPAC
- 3-(4-methoxyphenyl)-1-phenyl-3-piperidin-1-ylpropan-1-one;hydrochloride
Names & synonyms
24210-96-6DTXSID609470233-(4-Methoxyphenyl)-1-phenyl-3-(piperidin-1-yl)propan-1-one--hydrogen chloride (1/1)RefChem:1066880DTXCID901375291beta-(p-Methoxyphenyl)-beta-(1-piperidino)propiophenone hydrochloridePropiophenone, beta-(p-methoxyphenyl)-beta-(1-piperidino)-, hydrochloride
Database identifiers
- CAS
24210-96-6- PubChem CID
- 91138
- DTXSID
DTXSID60947023
Properties
Computed structural properties
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 377
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Related reactions
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Compound notes
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