About 3-hydroxy-N-(2-methylquinolin-8-yl)pyridine-4-carboxamide
3-hydroxy-N-(2-methylquinolin-8-yl)pyridine-4-carboxamide (PubChem CID 81440113) has the molecular formula C16H13N3O2
and a molecular weight of 279.30 g/mol. Its IUPAC name is 3-hydroxy-N-(2-methylquinolin-8-yl)pyridine-4-carboxamide.
Molecular Properties
| Compound Name | 3-hydroxy-N-(2-methylquinolin-8-yl)pyridine-4-carboxamide |
| PubChem CID | 81440113 |
| Molecular Formula | C16H13N3O2 |
| Molecular Weight | 279.30 g/mol |
| Exact Mass | 279.10 |
| IUPAC Name | 3-hydroxy-N-(2-methylquinolin-8-yl)pyridine-4-carboxamide |
| SMILES | Cc1ccc2cccc(NC(=O)c3ccncc3O)c2n1 |
| InChI | InChI=1S/C16H13N3O2/c1-10-5-6-11-3-2-4-13(15(11)18-10)19-16(21)12-7-8-17-9-14(12)20/h2-9,20H,1H3,(H,19,21) |
| InChIKey | YEWYKQCQUCQUDH-UHFFFAOYSA-N |
| XLogP | 2.90 |
| TPSA | 75.11 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 279.30 |
| LogP ≤ 5 | 2.90 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 3-hydroxy-N-(2-methylquinolin-8-yl)pyridine-4-carboxamide?
The IUPAC name of 3-hydroxy-N-(2-methylquinolin-8-yl)pyridine-4-carboxamide (CID 81440113) is 3-hydroxy-N-(2-methylquinolin-8-yl)pyridine-4-carboxamide.
What is the SMILES notation for 3-hydroxy-N-(2-methylquinolin-8-yl)pyridine-4-carboxamide?
The canonical SMILES for 3-hydroxy-N-(2-methylquinolin-8-yl)pyridine-4-carboxamide is Cc1ccc2cccc(NC(=O)c3ccncc3O)c2n1.
What is the InChIKey of 3-hydroxy-N-(2-methylquinolin-8-yl)pyridine-4-carboxamide?
The InChIKey is YEWYKQCQUCQUDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3O2/c1-10-5-6-11-3-2-4-13(15(11)18-10)19-16(21)12-7-8-17-9-14(12)20/h2-9,20H,1H3,(H,19,21).
What are the key properties of 3-hydroxy-N-(2-methylquinolin-8-yl)pyridine-4-carboxamide?
3-hydroxy-N-(2-methylquinolin-8-yl)pyridine-4-carboxamide has a molecular weight of 279.30 g/mol, XLogP of 2.90, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-(2-methylquinolin-8-yl)pyridine-4-carboxamide is sourced from PubChem (CID 81440113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).