3-(Dimethylamino)-2-phenyl-1-piperidin-1-ylprop-2-ene-1-thione
Basic information
- CAS
89099-53-6- Standard SMILES
CN(C)C=C(C(=S)N1CCCCC1)c1ccccc1- InChIKey
UMHSLBCWXTTYBQ-UHFFFAOYSA-N- Molecular formula
- C16H22N2S
- Average molar mass
- 274.4 g/mol
- Monoisotopic mass
- 274.15036988
Names & identifiers
- Preferred name
- 3-(Dimethylamino)-2-phenyl-1-piperidin-1-ylprop-2-ene-1-thione
- IUPAC
- 3-(dimethylamino)-2-phenyl-1-piperidin-1-ylprop-2-ene-1-thione
Names & synonyms
89099-53-6Piperidine, 1-[3-(dimethylamino)-2-phenyl-1-thioxo-2-propenyl]-DTXSID403458613-(Dimethylamino)-2-phenyl-1-(piperidin-1-yl)prop-2-ene-1-thione
Database identifiers
- CAS
89099-53-6- PubChem CID
- 607608
- DTXSID
DTXSID40345861
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 38.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 324
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Compound notes
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