4-(difluoromethyl)-5-hydroxy-6-oxo-1H-pyridine-2-carboxamide

C7H6F2N2O3 — CID 118828804

IUPAC4-(difluoromethyl)-5-hydroxy-6-oxo-1H-pyridine-2-carboxamide
SMILESNC(=O)c1cc(C(F)F)c(O)c(=O)[nH]1
InChIInChI=1S/C7H6F2N2O3/c8-5(9)2-1-3(6(10)13)11-7(14)4(2)12/h1,5,12H,(H2,10,13)(H,11,14)
InChIKeyXVQDBYUIUIXDEJ-UHFFFAOYSA-N
MW204.13 g/mol
LogP0.12
Rot. Bonds2

About 4-(difluoromethyl)-5-hydroxy-6-oxo-1H-pyridine-2-carboxamide

4-(difluoromethyl)-5-hydroxy-6-oxo-1H-pyridine-2-carboxamide (PubChem CID 118828804) has the molecular formula C7H6F2N2O3 and a molecular weight of 204.13 g/mol. Its IUPAC name is 4-(difluoromethyl)-5-hydroxy-6-oxo-1H-pyridine-2-carboxamide.

Molecular Properties

Compound Name4-(difluoromethyl)-5-hydroxy-6-oxo-1H-pyridine-2-carboxamide
PubChem CID118828804
Molecular FormulaC7H6F2N2O3
Molecular Weight204.13 g/mol
Exact Mass204.03
IUPAC Name4-(difluoromethyl)-5-hydroxy-6-oxo-1H-pyridine-2-carboxamide
SMILESNC(=O)c1cc(C(F)F)c(O)c(=O)[nH]1
InChIInChI=1S/C7H6F2N2O3/c8-5(9)2-1-3(6(10)13)11-7(14)4(2)12/h1,5,12H,(H2,10,13)(H,11,14)
InChIKeyXVQDBYUIUIXDEJ-UHFFFAOYSA-N
XLogP0.12
TPSA96.18 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.13
LogP ≤ 50.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(difluoromethyl)-5-hydroxy-6-oxo-1H-pyridine-2-carboxamide?
The IUPAC name of 4-(difluoromethyl)-5-hydroxy-6-oxo-1H-pyridine-2-carboxamide (CID 118828804) is 4-(difluoromethyl)-5-hydroxy-6-oxo-1H-pyridine-2-carboxamide.
What is the SMILES notation for 4-(difluoromethyl)-5-hydroxy-6-oxo-1H-pyridine-2-carboxamide?
The canonical SMILES for 4-(difluoromethyl)-5-hydroxy-6-oxo-1H-pyridine-2-carboxamide is NC(=O)c1cc(C(F)F)c(O)c(=O)[nH]1.
What is the InChIKey of 4-(difluoromethyl)-5-hydroxy-6-oxo-1H-pyridine-2-carboxamide?
The InChIKey is XVQDBYUIUIXDEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6F2N2O3/c8-5(9)2-1-3(6(10)13)11-7(14)4(2)12/h1,5,12H,(H2,10,13)(H,11,14).
What are the key properties of 4-(difluoromethyl)-5-hydroxy-6-oxo-1H-pyridine-2-carboxamide?
4-(difluoromethyl)-5-hydroxy-6-oxo-1H-pyridine-2-carboxamide has a molecular weight of 204.13 g/mol, XLogP of 0.12, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(difluoromethyl)-5-hydroxy-6-oxo-1H-pyridine-2-carboxamide is sourced from PubChem (CID 118828804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).