Basic information
- Standard SMILES
O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCC[C@@H](O)C1- InChIKey
OTZAQVZSSGICPC-SECBINFHSA-N- Molecular formula
- C12H13F3N2O3
- Average molar mass
- 290.24 g/mol
Names & identifiers
- Preferred name
- (R)-1-(2-nitro-4-(trifluoromethyl)phenyl)piperidin-3-ol
- IUPAC
- (3R)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidin-3-ol
Names & synonyms
(R)-1-(2-nitro-4-(trifluoromethyl)phenyl)piperidin-3-olSCHEMBL2963116SCHEMBL31587400
Database identifiers
- PubChem CID
- 7449941
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 69.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 359
Related reactions
4 records
Compound notes
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