Basic information
- Standard SMILES
CCCCC1CCN(CCCn2c(=O)oc3c(C)cc(C)cc32)CC1- InChIKey
YXCMDGIKHCLNKH-UHFFFAOYSA-N- Molecular formula
- C21H32N2O2
- Average molar mass
- 344.5 g/mol
- Monoisotopic mass
- 344.24637827
Names & identifiers
- Preferred name
- 3-[3-(4-Butylpiperidin-1-yl)propyl]-5,7-dimethyl-1,3-benzoxazol-2-one
- IUPAC
- 3-[3-(4-butylpiperidin-1-yl)propyl]-5,7-dimethyl-1,3-benzoxazol-2-one
Names & synonyms
SCHEMBL2149181
Database identifiers
- PubChem CID
- 21989999
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 32.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 434
Related reactions
1 records
Compound notes
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