About 5-(difluoromethyl)-3-hydroxypyridine-2-sulfonamide
5-(difluoromethyl)-3-hydroxypyridine-2-sulfonamide (PubChem CID 130097291) has the molecular formula C6H6F2N2O3S
and a molecular weight of 224.19 g/mol. Its IUPAC name is 5-(difluoromethyl)-3-hydroxypyridine-2-sulfonamide.
Molecular Properties
| Compound Name | 5-(difluoromethyl)-3-hydroxypyridine-2-sulfonamide |
| PubChem CID | 130097291 |
| Molecular Formula | C6H6F2N2O3S |
| Molecular Weight | 224.19 g/mol |
| Exact Mass | 224.01 |
| IUPAC Name | 5-(difluoromethyl)-3-hydroxypyridine-2-sulfonamide |
| SMILES | NS(=O)(=O)c1ncc(C(F)F)cc1O |
| InChI | InChI=1S/C6H6F2N2O3S/c7-5(8)3-1-4(11)6(10-2-3)14(9,12)13/h1-2,5,11H,(H2,9,12,13) |
| InChIKey | VJNCJTBIUWIZJD-UHFFFAOYSA-N |
| XLogP | 0.37 |
| TPSA | 93.28 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 224.19 |
| LogP ≤ 5 | 0.37 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 5-(difluoromethyl)-3-hydroxypyridine-2-sulfonamide?
The IUPAC name of 5-(difluoromethyl)-3-hydroxypyridine-2-sulfonamide (CID 130097291) is 5-(difluoromethyl)-3-hydroxypyridine-2-sulfonamide.
What is the SMILES notation for 5-(difluoromethyl)-3-hydroxypyridine-2-sulfonamide?
The canonical SMILES for 5-(difluoromethyl)-3-hydroxypyridine-2-sulfonamide is NS(=O)(=O)c1ncc(C(F)F)cc1O.
What is the InChIKey of 5-(difluoromethyl)-3-hydroxypyridine-2-sulfonamide?
The InChIKey is VJNCJTBIUWIZJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6F2N2O3S/c7-5(8)3-1-4(11)6(10-2-3)14(9,12)13/h1-2,5,11H,(H2,9,12,13).
What are the key properties of 5-(difluoromethyl)-3-hydroxypyridine-2-sulfonamide?
5-(difluoromethyl)-3-hydroxypyridine-2-sulfonamide has a molecular weight of 224.19 g/mol, XLogP of 0.37, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(difluoromethyl)-3-hydroxypyridine-2-sulfonamide is sourced from PubChem (CID 130097291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).