Basic information
- Standard SMILES
CC(C)OCc1nn(-c2ncccc2F)cc1CO- InChIKey
KWMWUIVOKDCJFF-UHFFFAOYSA-N- Molecular formula
- C13H16FN3O2
- Average molar mass
- 265.28 g/mol
- Monoisotopic mass
- 265.12265492
Names & identifiers
- Preferred name
- [1-(3-Fluoro-2-pyridyl)-3-(isopropoxymethyl)pyrazol-4-yl]methanol
- IUPAC
- [1-(3-fluoro-2-pyridinyl)-3-(propan-2-yloxymethyl)pyrazol-4-yl]methanol
Names & synonyms
SCHEMBL1804220KWMWUIVOKDCJFF-UHFFFAOYSA-N[1-(3-fluoro-2-pyridyl)-3-(isopropoxymethyl)pyrazol-4-yl]methanol
Database identifiers
- PubChem CID
- 67167174
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 60.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 281
Related reactions
4 records
Compound notes
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