About 3-(dimethylamino)-N-[3-[(4-methoxybenzoyl)amino]-4-methylphenyl]benzamide
3-(dimethylamino)-N-[3-[(4-methoxybenzoyl)amino]-4-methylphenyl]benzamide (PubChem CID 23443377) has the molecular formula C24H25N3O3
and a molecular weight of 403.48 g/mol. Its IUPAC name is 3-(dimethylamino)-N-[3-[(4-methoxybenzoyl)amino]-4-methylphenyl]benzamide.
Molecular Properties
| Compound Name | 3-(dimethylamino)-N-[3-[(4-methoxybenzoyl)amino]-4-methylphenyl]benzamide |
| PubChem CID | 23443377 |
| Molecular Formula | C24H25N3O3 |
| Molecular Weight | 403.48 g/mol |
| Exact Mass | 403.19 |
| IUPAC Name | 3-(dimethylamino)-N-[3-[(4-methoxybenzoyl)amino]-4-methylphenyl]benzamide |
| SMILES | COc1ccc(C(=O)Nc2cc(NC(=O)c3cccc(N(C)C)c3)ccc2C)cc1 |
| InChI | InChI=1S/C24H25N3O3/c1-16-8-11-19(25-24(29)18-6-5-7-20(14-18)27(2)3)15-22(16)26-23(28)17-9-12-21(30-4)13-10-17/h5-15H,1-4H3,(H,25,29)(H,26,28) |
| InChIKey | HDBXCACKAXIPCD-UHFFFAOYSA-N |
| XLogP | 4.57 |
| TPSA | 70.67 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 30 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 403.48 |
| LogP ≤ 5 | 4.57 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 3-(dimethylamino)-N-[3-[(4-methoxybenzoyl)amino]-4-methylphenyl]benzamide?
The IUPAC name of 3-(dimethylamino)-N-[3-[(4-methoxybenzoyl)amino]-4-methylphenyl]benzamide (CID 23443377) is 3-(dimethylamino)-N-[3-[(4-methoxybenzoyl)amino]-4-methylphenyl]benzamide.
What is the SMILES notation for 3-(dimethylamino)-N-[3-[(4-methoxybenzoyl)amino]-4-methylphenyl]benzamide?
The canonical SMILES for 3-(dimethylamino)-N-[3-[(4-methoxybenzoyl)amino]-4-methylphenyl]benzamide is COc1ccc(C(=O)Nc2cc(NC(=O)c3cccc(N(C)C)c3)ccc2C)cc1.
What is the InChIKey of 3-(dimethylamino)-N-[3-[(4-methoxybenzoyl)amino]-4-methylphenyl]benzamide?
The InChIKey is HDBXCACKAXIPCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O3/c1-16-8-11-19(25-24(29)18-6-5-7-20(14-18)27(2)3)15-22(16)26-23(28)17-9-12-21(30-4)13-10-17/h5-15H,1-4H3,(H,25,29)(H,26,28).
What are the key properties of 3-(dimethylamino)-N-[3-[(4-methoxybenzoyl)amino]-4-methylphenyl]benzamide?
3-(dimethylamino)-N-[3-[(4-methoxybenzoyl)amino]-4-methylphenyl]benzamide has a molecular weight of 403.48 g/mol, XLogP of 4.57, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)-N-[3-[(4-methoxybenzoyl)amino]-4-methylphenyl]benzamide is sourced from PubChem (CID 23443377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).