Basic information
- Standard SMILES
O=C(NCCCCO)c1ccncc1Nc1ccc(I)cc1F- InChIKey
YIVJNCFCFAGRRI-UHFFFAOYSA-N- Molecular formula
- C16H17FIN3O2
- Average molar mass
- 429.23 g/mol
Names & identifiers
- Preferred name
- 3-[(2-fluoro-4-iodophenyl)amino]-N-(4-hydroxybutyl)isonicotinamide
- IUPAC
- 3-(2-fluoro-4-iodoanilino)-N-(4-hydroxybutyl)pyridine-4-carboxamide
Names & synonyms
SCHEMBL2024492YIVJNCFCFAGRRI-UHFFFAOYSA-N3-[(2-fluoro-4-iodophenyl)amino]-N-(4-hydroxybutyl)isonicotinamide
Database identifiers
- PubChem CID
- 11611678
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 74.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 375
Related reactions
5 records
Compound notes
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