3-amino-N-(5-chloro-2-methoxyphenyl)-4-methylbenzamide
Basic information
- CAS
1016496-16-4- Standard SMILES
COc1ccc(Cl)cc1NC(=O)c1ccc(C)c(N)c1- InChIKey
TYOKBRGWILNEFQ-UHFFFAOYSA-N- Molecular formula
- C15H15ClN2O2
- Average molar mass
- 290.74 g/mol
- Monoisotopic mass
- 290.0822054
Names & identifiers
- Preferred name
- 3-amino-N-(5-chloro-2-methoxyphenyl)-4-methylbenzamide
- IUPAC
- 3-amino-N-(5-chloro-2-methoxyphenyl)-4-methylbenzamide
- English name
- 3-amino-N-(5-chloro-2-methoxyphenyl)-4-methylbenzamide
- Molecular formula
- C15H15ClN2O2
- Molecular weight
- 290.74
Names & synonyms
AKOS0001621043-amino-N-(5-chloro-2-methoxyphenyl)-4-methylbenzamideBenzamide, 3-amino-N-(5-chloro-2-methoxyphenyl)-4-methyl-
Database identifiers
- CAS
1016496-16-4- PubChem CID
- 18070517
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 64.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 340
Physicochemical properties
- Boiling point
- 405.8 · 405.8±45.0 °C(Predicted)
- Density
- 1.304 · 1.304±0.06 g/cm3(Predicted)
- pka
- 12.53 · 12.53±0.70(Predicted)
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Compound notes
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