Basic information
- Standard SMILES
COc1ccc(CSC2CCN(C)CC2)cc1- InChIKey
SGOANAXOHQRUIT-UHFFFAOYSA-N- Molecular formula
- C14H21NOS
- Average molar mass
- 251.39 g/mol
Names & identifiers
- Preferred name
- 4-(4-Methoxybenzylthio)-1-methylpiperidine
- IUPAC
- 4-[(4-methoxyphenyl)methylsulfanyl]-1-methylpiperidine
Names & synonyms
SCHEMBL9414489SGOANAXOHQRUIT-UHFFFAOYSA-N4-(4-Methoxybenzylthio)-1-methylpiperidine
Database identifiers
- PubChem CID
- 19797259
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 37.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 208
Related reactions
3 records
Compound notes
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