Basic information
- Standard SMILES
CS(=O)(=O)N1CC=C(c2ccc(O)cn2)CC1- InChIKey
PREQLYQYIDEVCU-UHFFFAOYSA-N- Molecular formula
- C11H14N2O3S
- Average molar mass
- 254.31 g/mol
- Monoisotopic mass
- 254.07251349
Names & identifiers
- Preferred name
- 1'-Methanesulfonyl-1',2',3',6'-tetrahydro-[2,4']bipyridinyl-5-ol
- IUPAC
- 6-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)pyridin-3-ol
Names & synonyms
1'-methanesulfonyl-1',2',3',6'-tetrahydro-[2,4']bipyridinyl-5-olSCHEMBL979389SCHEMBL27866857PREQLYQYIDEVCU-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 66865178
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 78.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 399
Related reactions
1 records
Compound notes
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