About 4-(2H-oxadiazol-3-yl)-N-phenylpyridine-3-carboxamide
4-(2H-oxadiazol-3-yl)-N-phenylpyridine-3-carboxamide (PubChem CID 70160006) has the molecular formula C14H12N4O2
and a molecular weight of 268.28 g/mol. Its IUPAC name is 4-(2H-oxadiazol-3-yl)-N-phenylpyridine-3-carboxamide.
Molecular Properties
| Compound Name | 4-(2H-oxadiazol-3-yl)-N-phenylpyridine-3-carboxamide |
| PubChem CID | 70160006 |
| Molecular Formula | C14H12N4O2 |
| Molecular Weight | 268.28 g/mol |
| Exact Mass | 268.10 |
| IUPAC Name | 4-(2H-oxadiazol-3-yl)-N-phenylpyridine-3-carboxamide |
| SMILES | O=C(Nc1ccccc1)c1cnccc1N1C=CON1 |
| InChI | InChI=1S/C14H12N4O2/c19-14(16-11-4-2-1-3-5-11)12-10-15-7-6-13(12)18-8-9-20-17-18/h1-10,17H,(H,16,19) |
| InChIKey | UTKCRXJZGNXUOF-UHFFFAOYSA-N |
| XLogP | 2.06 |
| TPSA | 66.49 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 268.28 |
| LogP ≤ 5 | 2.06 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 5 |
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Frequently Asked Questions
What is the IUPAC name of 4-(2H-oxadiazol-3-yl)-N-phenylpyridine-3-carboxamide?
The IUPAC name of 4-(2H-oxadiazol-3-yl)-N-phenylpyridine-3-carboxamide (CID 70160006) is 4-(2H-oxadiazol-3-yl)-N-phenylpyridine-3-carboxamide.
What is the SMILES notation for 4-(2H-oxadiazol-3-yl)-N-phenylpyridine-3-carboxamide?
The canonical SMILES for 4-(2H-oxadiazol-3-yl)-N-phenylpyridine-3-carboxamide is O=C(Nc1ccccc1)c1cnccc1N1C=CON1.
What is the InChIKey of 4-(2H-oxadiazol-3-yl)-N-phenylpyridine-3-carboxamide?
The InChIKey is UTKCRXJZGNXUOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N4O2/c19-14(16-11-4-2-1-3-5-11)12-10-15-7-6-13(12)18-8-9-20-17-18/h1-10,17H,(H,16,19).
What are the key properties of 4-(2H-oxadiazol-3-yl)-N-phenylpyridine-3-carboxamide?
4-(2H-oxadiazol-3-yl)-N-phenylpyridine-3-carboxamide has a molecular weight of 268.28 g/mol, XLogP of 2.06, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2H-oxadiazol-3-yl)-N-phenylpyridine-3-carboxamide is sourced from PubChem (CID 70160006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).