About N'-(2-methylphenyl)-N-(5-methyl-2-pyridinyl)oxamide
N'-(2-methylphenyl)-N-(5-methyl-2-pyridinyl)oxamide (PubChem CID 44997230) has the molecular formula C15H15N3O2
and a molecular weight of 269.30 g/mol. Its IUPAC name is N'-(2-methylphenyl)-N-(5-methyl-2-pyridinyl)oxamide.
Molecular Properties
| Compound Name | N'-(2-methylphenyl)-N-(5-methyl-2-pyridinyl)oxamide |
| PubChem CID | 44997230 |
| Molecular Formula | C15H15N3O2 |
| Molecular Weight | 269.30 g/mol |
| Exact Mass | 269.12 |
| IUPAC Name | N'-(2-methylphenyl)-N-(5-methyl-2-pyridinyl)oxamide |
| SMILES | Cc1ccc(NC(=O)C(=O)Nc2ccccc2C)nc1 |
| InChI | InChI=1S/C15H15N3O2/c1-10-7-8-13(16-9-10)18-15(20)14(19)17-12-6-4-3-5-11(12)2/h3-9H,1-2H3,(H,17,19)(H,16,18,20) |
| InChIKey | VYXIAWHTNWHZHP-UHFFFAOYSA-N |
| XLogP | 2.28 |
| TPSA | 71.09 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 269.30 |
| LogP ≤ 5 | 2.28 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'diketo_group', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N'-(2-methylphenyl)-N-(5-methyl-2-pyridinyl)oxamide?
The IUPAC name of N'-(2-methylphenyl)-N-(5-methyl-2-pyridinyl)oxamide (CID 44997230) is N'-(2-methylphenyl)-N-(5-methyl-2-pyridinyl)oxamide.
What is the SMILES notation for N'-(2-methylphenyl)-N-(5-methyl-2-pyridinyl)oxamide?
The canonical SMILES for N'-(2-methylphenyl)-N-(5-methyl-2-pyridinyl)oxamide is Cc1ccc(NC(=O)C(=O)Nc2ccccc2C)nc1.
What is the InChIKey of N'-(2-methylphenyl)-N-(5-methyl-2-pyridinyl)oxamide?
The InChIKey is VYXIAWHTNWHZHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2/c1-10-7-8-13(16-9-10)18-15(20)14(19)17-12-6-4-3-5-11(12)2/h3-9H,1-2H3,(H,17,19)(H,16,18,20).
What are the key properties of N'-(2-methylphenyl)-N-(5-methyl-2-pyridinyl)oxamide?
N'-(2-methylphenyl)-N-(5-methyl-2-pyridinyl)oxamide has a molecular weight of 269.30 g/mol, XLogP of 2.28, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-methylphenyl)-N-(5-methyl-2-pyridinyl)oxamide is sourced from PubChem (CID 44997230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).