About N-(4-chloro-3-fluorophenyl)-5-hydroxypyridine-3-carboxamide
N-(4-chloro-3-fluorophenyl)-5-hydroxypyridine-3-carboxamide (PubChem CID 63864787) has the molecular formula C12H8ClFN2O2
and a molecular weight of 266.66 g/mol. Its IUPAC name is N-(4-chloro-3-fluorophenyl)-5-hydroxypyridine-3-carboxamide.
Molecular Properties
| Compound Name | N-(4-chloro-3-fluorophenyl)-5-hydroxypyridine-3-carboxamide |
| PubChem CID | 63864787 |
| Molecular Formula | C12H8ClFN2O2 |
| Molecular Weight | 266.66 g/mol |
| Exact Mass | 266.03 |
| IUPAC Name | N-(4-chloro-3-fluorophenyl)-5-hydroxypyridine-3-carboxamide |
| SMILES | O=C(Nc1ccc(Cl)c(F)c1)c1cncc(O)c1 |
| InChI | InChI=1S/C12H8ClFN2O2/c13-10-2-1-8(4-11(10)14)16-12(18)7-3-9(17)6-15-5-7/h1-6,17H,(H,16,18) |
| InChIKey | ZRWYQZQVBGBHAW-UHFFFAOYSA-N |
| XLogP | 2.83 |
| TPSA | 62.22 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 266.66 |
| LogP ≤ 5 | 2.83 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of N-(4-chloro-3-fluorophenyl)-5-hydroxypyridine-3-carboxamide?
The IUPAC name of N-(4-chloro-3-fluorophenyl)-5-hydroxypyridine-3-carboxamide (CID 63864787) is N-(4-chloro-3-fluorophenyl)-5-hydroxypyridine-3-carboxamide.
What is the SMILES notation for N-(4-chloro-3-fluorophenyl)-5-hydroxypyridine-3-carboxamide?
The canonical SMILES for N-(4-chloro-3-fluorophenyl)-5-hydroxypyridine-3-carboxamide is O=C(Nc1ccc(Cl)c(F)c1)c1cncc(O)c1.
What is the InChIKey of N-(4-chloro-3-fluorophenyl)-5-hydroxypyridine-3-carboxamide?
The InChIKey is ZRWYQZQVBGBHAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8ClFN2O2/c13-10-2-1-8(4-11(10)14)16-12(18)7-3-9(17)6-15-5-7/h1-6,17H,(H,16,18).
What are the key properties of N-(4-chloro-3-fluorophenyl)-5-hydroxypyridine-3-carboxamide?
N-(4-chloro-3-fluorophenyl)-5-hydroxypyridine-3-carboxamide has a molecular weight of 266.66 g/mol, XLogP of 2.83, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-3-fluorophenyl)-5-hydroxypyridine-3-carboxamide is sourced from PubChem (CID 63864787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).