About 2-methyl-N-(4-pyridin-2-ylphenyl)propanamide
2-methyl-N-(4-pyridin-2-ylphenyl)propanamide (PubChem CID 110459868) has the molecular formula C15H16N2O
and a molecular weight of 240.31 g/mol. Its IUPAC name is 2-methyl-N-(4-pyridin-2-ylphenyl)propanamide.
Molecular Properties
| Compound Name | 2-methyl-N-(4-pyridin-2-ylphenyl)propanamide |
| PubChem CID | 110459868 |
| Molecular Formula | C15H16N2O |
| Molecular Weight | 240.31 g/mol |
| Exact Mass | 240.13 |
| IUPAC Name | 2-methyl-N-(4-pyridin-2-ylphenyl)propanamide |
| SMILES | CC(C)C(=O)Nc1ccc(-c2ccccn2)cc1 |
| InChI | InChI=1S/C15H16N2O/c1-11(2)15(18)17-13-8-6-12(7-9-13)14-5-3-4-10-16-14/h3-11H,1-2H3,(H,17,18) |
| InChIKey | MIAFBTOFYRYYNM-UHFFFAOYSA-N |
| XLogP | 3.34 |
| TPSA | 41.99 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 240.31 |
| LogP ≤ 5 | 3.34 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 2-methyl-N-(4-pyridin-2-ylphenyl)propanamide?
The IUPAC name of 2-methyl-N-(4-pyridin-2-ylphenyl)propanamide (CID 110459868) is 2-methyl-N-(4-pyridin-2-ylphenyl)propanamide.
What is the SMILES notation for 2-methyl-N-(4-pyridin-2-ylphenyl)propanamide?
The canonical SMILES for 2-methyl-N-(4-pyridin-2-ylphenyl)propanamide is CC(C)C(=O)Nc1ccc(-c2ccccn2)cc1.
What is the InChIKey of 2-methyl-N-(4-pyridin-2-ylphenyl)propanamide?
The InChIKey is MIAFBTOFYRYYNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O/c1-11(2)15(18)17-13-8-6-12(7-9-13)14-5-3-4-10-16-14/h3-11H,1-2H3,(H,17,18).
What are the key properties of 2-methyl-N-(4-pyridin-2-ylphenyl)propanamide?
2-methyl-N-(4-pyridin-2-ylphenyl)propanamide has a molecular weight of 240.31 g/mol, XLogP of 3.34, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(4-pyridin-2-ylphenyl)propanamide is sourced from PubChem (CID 110459868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).