4-(1-Piperidinyl)-4-phenyltetrahydro-2H-thiopyran
Basic information
- Standard SMILES
c1ccc(C2(N3CCCCC3)CCSCC2)cc1- InChIKey
RIIRMUBUGPAIQD-UHFFFAOYSA-N- Molecular formula
- C16H23NS
- Average molar mass
- 261.4 g/mol
- Monoisotopic mass
- 261.15512091
Names & identifiers
- Preferred name
- 4-(1-Piperidinyl)-4-phenyltetrahydro-2H-thiopyran
- IUPAC
- 1-(4-phenylthian-4-yl)piperidine
Names & synonyms
4-(1-Piperidinyl)-4-phenyltetrahydro-2H-thiopyranDTXSID201342405
Database identifiers
- PubChem CID
- 210772
- DTXSID
DTXSID201342405- Nikkaji
- J759.571I
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 28.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 248
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Compound notes
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