1-Propanone, 2-methyl-3-(1-piperidinyl)-1-(4-propylphenyl)-
Basic information
- CAS
64840-91-1- Standard SMILES
CCCc1ccc(C(=O)C(C)CN2CCCCC2)cc1- InChIKey
CQWKBCFFMYVYGI-UHFFFAOYSA-N- Molecular formula
- C18H27NO
- Average molar mass
- 273.4 g/mol
- Monoisotopic mass
- 273.20926449
Names & identifiers
- Preferred name
- 1-Propanone, 2-methyl-3-(1-piperidinyl)-1-(4-propylphenyl)-
- IUPAC
- 2-methyl-3-piperidin-1-yl-1-(4-propylphenyl)propan-1-one
Names & synonyms
64840-91-11-Propanone, 2-methyl-3-(1-piperidinyl)-1-(4-propylphenyl)-CHEMBL6198978SCHEMBL10850593DTXSID304322392-METHYL-3-(PIPERIDIN-1-YL)-1-(4-PROPYLPHENYL)PROPAN-1-ONE
Database identifiers
- CAS
64840-91-1- PubChem CID
- 9878643
- DTXSID
DTXSID30432239- ChEMBL
CHEMBL6198978
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 288
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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