Basic information
- Standard SMILES
O=C(NCC1CC1)c1ccncc1Nc1ccc(I)cc1F- InChIKey
UXSGCJRGQHYYOD-UHFFFAOYSA-N- Molecular formula
- C16H15FIN3O
- Average molar mass
- 411.21 g/mol
Names & identifiers
- Preferred name
- N-(cyclopropylmethyl)-3-[(2-fluoro-4-iodophenyl)amino]isonicotinamide
- IUPAC
- N-(cyclopropylmethyl)-3-(2-fluoro-4-iodoanilino)pyridine-4-carboxamide
Names & synonyms
SCHEMBL2022186UXSGCJRGQHYYOD-UHFFFAOYSA-NN-(cyclopropylmethyl)-3-[(2-fluoro-4-iodophenyl)amino]isonicotinamide
Database identifiers
- PubChem CID
- 11567754
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 54 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 394
Related reactions
5 records
Compound notes
Loading…