About N-(5-bromo-2-methylphenyl)-2-(methylamino)benzamide
N-(5-bromo-2-methylphenyl)-2-(methylamino)benzamide (PubChem CID 61375909) has the molecular formula C15H15BrN2O
and a molecular weight of 319.20 g/mol. Its IUPAC name is N-(5-bromo-2-methylphenyl)-2-(methylamino)benzamide.
Molecular Properties
| Compound Name | N-(5-bromo-2-methylphenyl)-2-(methylamino)benzamide |
| PubChem CID | 61375909 |
| Molecular Formula | C15H15BrN2O |
| Molecular Weight | 319.20 g/mol |
| Exact Mass | 318.04 |
| IUPAC Name | N-(5-bromo-2-methylphenyl)-2-(methylamino)benzamide |
| SMILES | CNc1ccccc1C(=O)Nc1cc(Br)ccc1C |
| InChI | InChI=1S/C15H15BrN2O/c1-10-7-8-11(16)9-14(10)18-15(19)12-5-3-4-6-13(12)17-2/h3-9,17H,1-2H3,(H,18,19) |
| InChIKey | DGZMYEWEYHBQBB-UHFFFAOYSA-N |
| XLogP | 4.05 |
| TPSA | 41.13 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 319.20 |
| LogP ≤ 5 | 4.05 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of N-(5-bromo-2-methylphenyl)-2-(methylamino)benzamide?
The IUPAC name of N-(5-bromo-2-methylphenyl)-2-(methylamino)benzamide (CID 61375909) is N-(5-bromo-2-methylphenyl)-2-(methylamino)benzamide.
What is the SMILES notation for N-(5-bromo-2-methylphenyl)-2-(methylamino)benzamide?
The canonical SMILES for N-(5-bromo-2-methylphenyl)-2-(methylamino)benzamide is CNc1ccccc1C(=O)Nc1cc(Br)ccc1C.
What is the InChIKey of N-(5-bromo-2-methylphenyl)-2-(methylamino)benzamide?
The InChIKey is DGZMYEWEYHBQBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrN2O/c1-10-7-8-11(16)9-14(10)18-15(19)12-5-3-4-6-13(12)17-2/h3-9,17H,1-2H3,(H,18,19).
What are the key properties of N-(5-bromo-2-methylphenyl)-2-(methylamino)benzamide?
N-(5-bromo-2-methylphenyl)-2-(methylamino)benzamide has a molecular weight of 319.20 g/mol, XLogP of 4.05, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-2-methylphenyl)-2-(methylamino)benzamide is sourced from PubChem (CID 61375909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).