Basic information
- Standard SMILES
CN1CCC(c2cccc(S(C)(=O)=O)c2F)CC1- InChIKey
YLEYPGVTFYPUQA-UHFFFAOYSA-N- Molecular formula
- C13H18FNO2S
- Average molar mass
- 271.35 g/mol
- Monoisotopic mass
- 271.10422815
Names & identifiers
- Preferred name
- 4-[2-Fluoro-3-(methylsulfonyl)phenyl]-1-methylpiperidine
- IUPAC
- 4-(2-fluoro-3-methylsulfonylphenyl)-1-methylpiperidine
Names & synonyms
SCHEMBL2782932YLEYPGVTFYPUQA-UHFFFAOYSA-N4-[2-FLUORO-3-(METHYLSULFONYL)PHENYL]-1-METHYLPIPERIDINE
Database identifiers
- PubChem CID
- 57448043
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 45.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 371
Related reactions
3 records
Compound notes
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