4-(difluoromethyl)-5-hydroxy-6-oxo-1H-pyridine-3-carboxamide

C7H6F2N2O3 — CID 130100336

IUPAC4-(difluoromethyl)-5-hydroxy-6-oxo-1H-pyridine-3-carboxamide
SMILESNC(=O)c1c[nH]c(=O)c(O)c1C(F)F
InChIInChI=1S/C7H6F2N2O3/c8-5(9)3-2(6(10)13)1-11-7(14)4(3)12/h1,5,12H,(H2,10,13)(H,11,14)
InChIKeyZPEXNCNMUWPSAH-UHFFFAOYSA-N
MW204.13 g/mol
LogP0.12
Rot. Bonds2

About 4-(difluoromethyl)-5-hydroxy-6-oxo-1H-pyridine-3-carboxamide

4-(difluoromethyl)-5-hydroxy-6-oxo-1H-pyridine-3-carboxamide (PubChem CID 130100336) 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-3-carboxamide.

Molecular Properties

Compound Name4-(difluoromethyl)-5-hydroxy-6-oxo-1H-pyridine-3-carboxamide
PubChem CID130100336
Molecular FormulaC7H6F2N2O3
Molecular Weight204.13 g/mol
Exact Mass204.03
IUPAC Name4-(difluoromethyl)-5-hydroxy-6-oxo-1H-pyridine-3-carboxamide
SMILESNC(=O)c1c[nH]c(=O)c(O)c1C(F)F
InChIInChI=1S/C7H6F2N2O3/c8-5(9)3-2(6(10)13)1-11-7(14)4(3)12/h1,5,12H,(H2,10,13)(H,11,14)
InChIKeyZPEXNCNMUWPSAH-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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Related Compounds

2-[4-(difluoromethyl)-5-hydroxy-6-oxo-1H-pyridin-3-yl]acetic acid
CID 118841203
5-bromo-3-(difluoromethyl)-4-hydroxy-1H-pyridin-2-one
CID 130099978
3-(difluoromethyl)-5-hydroxy-4-methyl-1H-pyridin-2-one
CID 130100101
5-(difluoromethyl)-3,4-dihydroxy-1H-pyridin-2-one
CID 130088807
5-chloro-4-(difluoromethyl)-6-oxo-1H-pyridine-3-carbonyl chloride
CID 130072819
6-(difluoromethyl)-5-fluoro-4-oxo-1H-pyridine-3-carboxamide
CID 118848607
3-hydroxy-2-oxo-1H-pyridine-4-carboxamide
CID 67593311
3-chloro-4-(difluoromethyl)-5-hydroxy-1H-pyridin-2-one
CID 130100000
4-amino-3-(difluoromethyl)-5-fluoro-1H-pyridin-2-one
CID 118805633
2-(difluoromethyl)-3-hydroxy-6-oxo-1H-pyridine-4-carboxamide
CID 118820480
5-chloro-3-(difluoromethyl)-2-oxo-1H-pyridine-4-carboxylic acid
CID 130072683
2-[5-(difluoromethyl)-4-fluoro-6-oxo-1H-pyridin-3-yl]acetic acid
CID 130079710

Frequently Asked Questions

What is the IUPAC name of 4-(difluoromethyl)-5-hydroxy-6-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of 4-(difluoromethyl)-5-hydroxy-6-oxo-1H-pyridine-3-carboxamide (CID 130100336) is 4-(difluoromethyl)-5-hydroxy-6-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for 4-(difluoromethyl)-5-hydroxy-6-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for 4-(difluoromethyl)-5-hydroxy-6-oxo-1H-pyridine-3-carboxamide is NC(=O)c1c[nH]c(=O)c(O)c1C(F)F.
What is the InChIKey of 4-(difluoromethyl)-5-hydroxy-6-oxo-1H-pyridine-3-carboxamide?
The InChIKey is ZPEXNCNMUWPSAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6F2N2O3/c8-5(9)3-2(6(10)13)1-11-7(14)4(3)12/h1,5,12H,(H2,10,13)(H,11,14).
What are the key properties of 4-(difluoromethyl)-5-hydroxy-6-oxo-1H-pyridine-3-carboxamide?
4-(difluoromethyl)-5-hydroxy-6-oxo-1H-pyridine-3-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-3-carboxamide is sourced from PubChem (CID 130100336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).