2-hydroxy-6-oxo-4-(trifluoromethyl)-1H-pyridine-3-carboxamide

C7H5F3N2O3 — CID 122360887

IUPAC2-hydroxy-6-oxo-4-(trifluoromethyl)-1H-pyridine-3-carboxamide
SMILESNC(=O)c1c(C(F)(F)F)cc(=O)[nH]c1O
InChIInChI=1S/C7H5F3N2O3/c8-7(9,10)2-1-3(13)12-6(15)4(2)5(11)14/h1H,(H2,11,14)(H2,12,13,15)
InChIKeyKDSMEIPKCBRYMJ-UHFFFAOYSA-N
MW222.12 g/mol
LogP0.20
Rot. Bonds1

About 2-hydroxy-6-oxo-4-(trifluoromethyl)-1H-pyridine-3-carboxamide

2-hydroxy-6-oxo-4-(trifluoromethyl)-1H-pyridine-3-carboxamide (PubChem CID 122360887) has the molecular formula C7H5F3N2O3 and a molecular weight of 222.12 g/mol. Its IUPAC name is 2-hydroxy-6-oxo-4-(trifluoromethyl)-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name2-hydroxy-6-oxo-4-(trifluoromethyl)-1H-pyridine-3-carboxamide
PubChem CID122360887
Molecular FormulaC7H5F3N2O3
Molecular Weight222.12 g/mol
Exact Mass222.03
IUPAC Name2-hydroxy-6-oxo-4-(trifluoromethyl)-1H-pyridine-3-carboxamide
SMILESNC(=O)c1c(C(F)(F)F)cc(=O)[nH]c1O
InChIInChI=1S/C7H5F3N2O3/c8-7(9,10)2-1-3(13)12-6(15)4(2)5(11)14/h1H,(H2,11,14)(H2,12,13,15)
InChIKeyKDSMEIPKCBRYMJ-UHFFFAOYSA-N
XLogP0.20
TPSA96.18 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.12
LogP ≤ 50.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-6-oxo-4-(trifluoromethyl)-1H-pyridine-3-carboxamide?
The IUPAC name of 2-hydroxy-6-oxo-4-(trifluoromethyl)-1H-pyridine-3-carboxamide (CID 122360887) is 2-hydroxy-6-oxo-4-(trifluoromethyl)-1H-pyridine-3-carboxamide.
What is the SMILES notation for 2-hydroxy-6-oxo-4-(trifluoromethyl)-1H-pyridine-3-carboxamide?
The canonical SMILES for 2-hydroxy-6-oxo-4-(trifluoromethyl)-1H-pyridine-3-carboxamide is NC(=O)c1c(C(F)(F)F)cc(=O)[nH]c1O.
What is the InChIKey of 2-hydroxy-6-oxo-4-(trifluoromethyl)-1H-pyridine-3-carboxamide?
The InChIKey is KDSMEIPKCBRYMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5F3N2O3/c8-7(9,10)2-1-3(13)12-6(15)4(2)5(11)14/h1H,(H2,11,14)(H2,12,13,15).
What are the key properties of 2-hydroxy-6-oxo-4-(trifluoromethyl)-1H-pyridine-3-carboxamide?
2-hydroxy-6-oxo-4-(trifluoromethyl)-1H-pyridine-3-carboxamide has a molecular weight of 222.12 g/mol, XLogP of 0.20, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-6-oxo-4-(trifluoromethyl)-1H-pyridine-3-carboxamide is sourced from PubChem (CID 122360887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).