3-fluoro-5-iodo-N,N-dimethyl-2-[(pyridin-4-ylmethyl)-amino]-benzamide
Basic information
- Standard SMILES
CN(C)C(=O)c1cc(I)cc(F)c1NCc1ccncc1- InChIKey
RHRFOTVDCAPHGF-UHFFFAOYSA-N- Molecular formula
- C15H15FIN3O
- Average molar mass
- 399.2 g/mol
- Monoisotopic mass
- 399.02439
Names & identifiers
- Preferred name
- 3-fluoro-5-iodo-N,N-dimethyl-2-[(pyridin-4-ylmethyl)-amino]-benzamide
- IUPAC
- 3-fluoro-5-iodo-N,N-dimethyl-2-(pyridin-4-ylmethylamino)benzamide
Names & synonyms
SCHEMBL3563051RHRFOTVDCAPHGF-UHFFFAOYSA-N3-fluoro-5-iodo-N,N-dimethyl-2-[(pyridin-4-ylmethyl)-amino]-benzamide
Database identifiers
- PubChem CID
- 57731552
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 45.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 350
Related reactions
4 records
Compound notes
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