Basic information
- Standard SMILES
O=C(NCC1CCCN(CCc2ccc(F)cc2)C1)OCc1ccccc1- InChIKey
NTDZVPMXPROJMO-UHFFFAOYSA-N- Molecular formula
- C22H27FN2O2
- Average molar mass
- 370.5 g/mol
- Monoisotopic mass
- 370.20565627
Names & identifiers
- Preferred name
- {1-[2-(4-Fluorophenyl)ethyl]-piperidin-3-ylmethyl}carbamic Acid Benzyl Ester
- IUPAC
- benzyl N-[[1-[2-(4-fluorophenyl)ethyl]piperidin-3-yl]methyl]carbamate
Names & synonyms
SCHEMBL6312827NTDZVPMXPROJMO-UHFFFAOYSA-N{1-[2-(4-Fluorophenyl)ethyl]-piperidin-3-ylmethyl}carbamic Acid Benzyl Ester
Database identifiers
- PubChem CID
- 69738345
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 41.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 434
Related reactions
4 records
Compound notes
Loading…