About 2-methyl-N-(4-phenoxyphenyl)pyridine-3-carboxamide
2-methyl-N-(4-phenoxyphenyl)pyridine-3-carboxamide (PubChem CID 110862622) has the molecular formula C19H16N2O2
and a molecular weight of 304.35 g/mol. Its IUPAC name is 2-methyl-N-(4-phenoxyphenyl)pyridine-3-carboxamide.
Molecular Properties
| Compound Name | 2-methyl-N-(4-phenoxyphenyl)pyridine-3-carboxamide |
| PubChem CID | 110862622 |
| Molecular Formula | C19H16N2O2 |
| Molecular Weight | 304.35 g/mol |
| Exact Mass | 304.12 |
| IUPAC Name | 2-methyl-N-(4-phenoxyphenyl)pyridine-3-carboxamide |
| SMILES | Cc1ncccc1C(=O)Nc1ccc(Oc2ccccc2)cc1 |
| InChI | InChI=1S/C19H16N2O2/c1-14-18(8-5-13-20-14)19(22)21-15-9-11-17(12-10-15)23-16-6-3-2-4-7-16/h2-13H,1H3,(H,21,22) |
| InChIKey | ZYTSPIYRMFVMEY-UHFFFAOYSA-N |
| XLogP | 4.43 |
| TPSA | 51.22 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 23 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 304.35 |
| LogP ≤ 5 | 4.43 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 2-methyl-N-(4-phenoxyphenyl)pyridine-3-carboxamide?
The IUPAC name of 2-methyl-N-(4-phenoxyphenyl)pyridine-3-carboxamide (CID 110862622) is 2-methyl-N-(4-phenoxyphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-methyl-N-(4-phenoxyphenyl)pyridine-3-carboxamide?
The canonical SMILES for 2-methyl-N-(4-phenoxyphenyl)pyridine-3-carboxamide is Cc1ncccc1C(=O)Nc1ccc(Oc2ccccc2)cc1.
What is the InChIKey of 2-methyl-N-(4-phenoxyphenyl)pyridine-3-carboxamide?
The InChIKey is ZYTSPIYRMFVMEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O2/c1-14-18(8-5-13-20-14)19(22)21-15-9-11-17(12-10-15)23-16-6-3-2-4-7-16/h2-13H,1H3,(H,21,22).
What are the key properties of 2-methyl-N-(4-phenoxyphenyl)pyridine-3-carboxamide?
2-methyl-N-(4-phenoxyphenyl)pyridine-3-carboxamide has a molecular weight of 304.35 g/mol, XLogP of 4.43, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(4-phenoxyphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 110862622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).