Basic information
- Standard SMILES
O=C(NC1CCC1)c1ccncc1Nc1ccc(I)cc1F- InChIKey
SYJAXTFFLWSJHU-UHFFFAOYSA-N- Molecular formula
- C16H15FIN3O
- Average molar mass
- 411.21 g/mol
Names & identifiers
- Preferred name
- N-(cyclobutyl)-3-[(2-fluoro-4-iodophenyl)amino]isonicotinamide
- IUPAC
- N-cyclobutyl-3-(2-fluoro-4-iodoanilino)pyridine-4-carboxamide
Names & synonyms
SCHEMBL2023535SYJAXTFFLWSJHU-UHFFFAOYSA-NN-(cyclobutyl)-3-[(2-fluoro-4-iodophenyl)amino]isonicotinamide
Database identifiers
- PubChem CID
- 11531663
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 54 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 394
Related reactions
5 records
Linked notes
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