Basic information
- Standard SMILES
COc1ccnc(OC)c1C1CCCC(=O)N1Cc1ccc(F)c(-c2ccccn2)c1- InChIKey
ITIAEHHNBTWJML-UHFFFAOYSA-N- Molecular formula
- C24H24FN3O3
- Average molar mass
- 421.5 g/mol
Names & identifiers
- Preferred name
- 6-(2,4-Dimethoxypyridin-3-yl)-1-(4-fluoro-3-(pyridin-2-yl)benzyl)piperidin-2-one
- IUPAC
- 6-(2,4-dimethoxy-3-pyridinyl)-1-[(4-fluoro-3-pyridin-2-ylphenyl)methyl]piperidin-2-one
Names & synonyms
SCHEMBL4540639CHEMBL3975042ITIAEHHNBTWJML-UHFFFAOYSA-NBDBM202912US9242970, 596-(2,4-dimethoxypyridin-3-yl)-1-(4-fluoro-3-(pyridin-2-yl)benzyl)piperidin-2-one
Database identifiers
- PubChem CID
- 69084595
- ChEMBL
CHEMBL3975042
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 64.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 594
Related reactions
1 records
Compound notes
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