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

C8H7F3N2O3 — CID 139891630

IUPAC2-hydroxy-1-methyl-6-oxo-4-(trifluoromethyl)pyridine-3-carboxamide
SMILESCn1c(O)c(C(N)=O)c(C(F)(F)F)cc1=O
InChIInChI=1S/C8H7F3N2O3/c1-13-4(14)2-3(8(9,10)11)5(6(12)15)7(13)16/h2,16H,1H3,(H2,12,15)
InChIKeyFIWAFJKFFUWYMX-UHFFFAOYSA-N
MW236.15 g/mol
LogP0.21
Rot. Bonds1

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

2-hydroxy-1-methyl-6-oxo-4-(trifluoromethyl)pyridine-3-carboxamide (PubChem CID 139891630) has the molecular formula C8H7F3N2O3 and a molecular weight of 236.15 g/mol. Its IUPAC name is 2-hydroxy-1-methyl-6-oxo-4-(trifluoromethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-hydroxy-1-methyl-6-oxo-4-(trifluoromethyl)pyridine-3-carboxamide
PubChem CID139891630
Molecular FormulaC8H7F3N2O3
Molecular Weight236.15 g/mol
Exact Mass236.04
IUPAC Name2-hydroxy-1-methyl-6-oxo-4-(trifluoromethyl)pyridine-3-carboxamide
SMILESCn1c(O)c(C(N)=O)c(C(F)(F)F)cc1=O
InChIInChI=1S/C8H7F3N2O3/c1-13-4(14)2-3(8(9,10)11)5(6(12)15)7(13)16/h2,16H,1H3,(H2,12,15)
InChIKeyFIWAFJKFFUWYMX-UHFFFAOYSA-N
XLogP0.21
TPSA85.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.15
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-1-methyl-6-oxo-4-(trifluoromethyl)pyridine-3-carboxamide?
The IUPAC name of 2-hydroxy-1-methyl-6-oxo-4-(trifluoromethyl)pyridine-3-carboxamide (CID 139891630) is 2-hydroxy-1-methyl-6-oxo-4-(trifluoromethyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-hydroxy-1-methyl-6-oxo-4-(trifluoromethyl)pyridine-3-carboxamide?
The canonical SMILES for 2-hydroxy-1-methyl-6-oxo-4-(trifluoromethyl)pyridine-3-carboxamide is Cn1c(O)c(C(N)=O)c(C(F)(F)F)cc1=O.
What is the InChIKey of 2-hydroxy-1-methyl-6-oxo-4-(trifluoromethyl)pyridine-3-carboxamide?
The InChIKey is FIWAFJKFFUWYMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7F3N2O3/c1-13-4(14)2-3(8(9,10)11)5(6(12)15)7(13)16/h2,16H,1H3,(H2,12,15).
What are the key properties of 2-hydroxy-1-methyl-6-oxo-4-(trifluoromethyl)pyridine-3-carboxamide?
2-hydroxy-1-methyl-6-oxo-4-(trifluoromethyl)pyridine-3-carboxamide has a molecular weight of 236.15 g/mol, XLogP of 0.21, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-1-methyl-6-oxo-4-(trifluoromethyl)pyridine-3-carboxamide is sourced from PubChem (CID 139891630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).