About N-(3-methylphenyl)-2-phenoxypyridine-3-carboxamide
N-(3-methylphenyl)-2-phenoxypyridine-3-carboxamide (PubChem CID 24513585) has the molecular formula C19H16N2O2
and a molecular weight of 304.35 g/mol. Its IUPAC name is N-(3-methylphenyl)-2-phenoxypyridine-3-carboxamide.
Molecular Properties
| Compound Name | N-(3-methylphenyl)-2-phenoxypyridine-3-carboxamide |
| PubChem CID | 24513585 |
| Molecular Formula | C19H16N2O2 |
| Molecular Weight | 304.35 g/mol |
| Exact Mass | 304.12 |
| IUPAC Name | N-(3-methylphenyl)-2-phenoxypyridine-3-carboxamide |
| SMILES | Cc1cccc(NC(=O)c2cccnc2Oc2ccccc2)c1 |
| InChI | InChI=1S/C19H16N2O2/c1-14-7-5-8-15(13-14)21-18(22)17-11-6-12-20-19(17)23-16-9-3-2-4-10-16/h2-13H,1H3,(H,21,22) |
| InChIKey | XMHJGVDHEFXBKS-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 N-(3-methylphenyl)-2-phenoxypyridine-3-carboxamide?
The IUPAC name of N-(3-methylphenyl)-2-phenoxypyridine-3-carboxamide (CID 24513585) is N-(3-methylphenyl)-2-phenoxypyridine-3-carboxamide.
What is the SMILES notation for N-(3-methylphenyl)-2-phenoxypyridine-3-carboxamide?
The canonical SMILES for N-(3-methylphenyl)-2-phenoxypyridine-3-carboxamide is Cc1cccc(NC(=O)c2cccnc2Oc2ccccc2)c1.
What is the InChIKey of N-(3-methylphenyl)-2-phenoxypyridine-3-carboxamide?
The InChIKey is XMHJGVDHEFXBKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O2/c1-14-7-5-8-15(13-14)21-18(22)17-11-6-12-20-19(17)23-16-9-3-2-4-10-16/h2-13H,1H3,(H,21,22).
What are the key properties of N-(3-methylphenyl)-2-phenoxypyridine-3-carboxamide?
N-(3-methylphenyl)-2-phenoxypyridine-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 N-(3-methylphenyl)-2-phenoxypyridine-3-carboxamide is sourced from PubChem (CID 24513585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).