Basic information
- Standard SMILES
O=C(O)c1c(F)cccc1NCc1ccncc1- InChIKey
WJHTURFXANZUCM-UHFFFAOYSA-N- Molecular formula
- C13H11FN2O2
- Average molar mass
- 246.24 g/mol
Names & identifiers
- Preferred name
- 2-Fluoro-6-[(pyridin-4-ylmethyl)-amino]-benzoic acid
- IUPAC
- 2-fluoro-6-(pyridin-4-ylmethylamino)benzoic acid
Names & synonyms
SCHEMBL1715550WJHTURFXANZUCM-UHFFFAOYSA-NAKOS018078132DB-4234072-Fluoro-6-[(4-pyridinylmethyl)amino]benzoic acid2-Fluoro-6-[(pyridin-4-ylmethyl)-amino]-benzoic acid854381-84-3
Database identifiers
- PubChem CID
- 58989809
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 62.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 282
Related reactions
2 records
Compound notes
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