Basic information
- Standard SMILES
CN(C)C(=O)c1cc(I)cc(F)c1N- InChIKey
JBAHGAQEDZROLF-UHFFFAOYSA-N- Molecular formula
- C9H10FIN2O
- Average molar mass
- 308.09 g/mol
- Monoisotopic mass
- 307.98219
Names & identifiers
- Preferred name
- 2-amino-3-fluoro-5-iodo-N,N-dimethyl-benzamide
- IUPAC
- 2-amino-3-fluoro-5-iodo-N,N-dimethylbenzamide
Names & synonyms
SCHEMBL3567203JBAHGAQEDZROLF-UHFFFAOYSA-NDB-4228192-amino-3-fluoro-5-iodo-N,N-dimethylbenzamide2-amino-3-fluoro-5-iodo-N,N-dimethyl-benzamide1070978-03-8
Database identifiers
- PubChem CID
- 57731539
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 46.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 225
Related reactions
3 records
Compound notes
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