Basic information
- Standard SMILES
O=c1cc(OCc2ccc(C(F)(F)F)nc2)cc[nH]1- InChIKey
SHTZUYDEXVQLFA-UHFFFAOYSA-N- Molecular formula
- C12H9F3N2O2
- Average molar mass
- 270.21 g/mol
Names & identifiers
- Preferred name
- 4-((6-(Trifluoromethyl)pyridin-3-yl)methoxy)pyridin-2(1H)-one
- IUPAC
- 4-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]-1H-pyridin-2-one
Names & synonyms
4-((6-(Trifluoromethyl)pyridin-3-yl)methoxy)pyridin-2(1H)-oneSCHEMBL137964
Database identifiers
- PubChem CID
- 57950360
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 51.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 404
Related reactions
6 records
Compound notes
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