4-hydroxy-N-methyl-2-oxo-1H-quinoline-3-carboxamide

C11H10N2O3 — CID 54684039

IUPAC4-hydroxy-N-methyl-2-oxo-1H-quinoline-3-carboxamide
SMILESCNC(=O)c1c(O)c2ccccc2[nH]c1=O
InChIInChI=1S/C11H10N2O3/c1-12-10(15)8-9(14)6-4-2-3-5-7(6)13-11(8)16/h2-5H,1H3,(H,12,15)(H2,13,14,16)
InChIKeyQATJOQLILULHDL-UHFFFAOYSA-N
MW218.21 g/mol
LogP0.59
Rot. Bonds1

About 4-hydroxy-N-methyl-2-oxo-1H-quinoline-3-carboxamide

4-hydroxy-N-methyl-2-oxo-1H-quinoline-3-carboxamide (PubChem CID 54684039) has the molecular formula C11H10N2O3 and a molecular weight of 218.21 g/mol. Its IUPAC name is 4-hydroxy-N-methyl-2-oxo-1H-quinoline-3-carboxamide.

Molecular Properties

Compound Name4-hydroxy-N-methyl-2-oxo-1H-quinoline-3-carboxamide
PubChem CID54684039
Molecular FormulaC11H10N2O3
Molecular Weight218.21 g/mol
Exact Mass218.07
IUPAC Name4-hydroxy-N-methyl-2-oxo-1H-quinoline-3-carboxamide
SMILESCNC(=O)c1c(O)c2ccccc2[nH]c1=O
InChIInChI=1S/C11H10N2O3/c1-12-10(15)8-9(14)6-4-2-3-5-7(6)13-11(8)16/h2-5H,1H3,(H,12,15)(H2,13,14,16)
InChIKeyQATJOQLILULHDL-UHFFFAOYSA-N
XLogP0.59
TPSA82.19 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.21
LogP ≤ 50.59
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-methyl-2-oxo-1H-quinoline-3-carboxamide?
The IUPAC name of 4-hydroxy-N-methyl-2-oxo-1H-quinoline-3-carboxamide (CID 54684039) is 4-hydroxy-N-methyl-2-oxo-1H-quinoline-3-carboxamide.
What is the SMILES notation for 4-hydroxy-N-methyl-2-oxo-1H-quinoline-3-carboxamide?
The canonical SMILES for 4-hydroxy-N-methyl-2-oxo-1H-quinoline-3-carboxamide is CNC(=O)c1c(O)c2ccccc2[nH]c1=O.
What is the InChIKey of 4-hydroxy-N-methyl-2-oxo-1H-quinoline-3-carboxamide?
The InChIKey is QATJOQLILULHDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O3/c1-12-10(15)8-9(14)6-4-2-3-5-7(6)13-11(8)16/h2-5H,1H3,(H,12,15)(H2,13,14,16).
What are the key properties of 4-hydroxy-N-methyl-2-oxo-1H-quinoline-3-carboxamide?
4-hydroxy-N-methyl-2-oxo-1H-quinoline-3-carboxamide has a molecular weight of 218.21 g/mol, XLogP of 0.59, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-methyl-2-oxo-1H-quinoline-3-carboxamide is sourced from PubChem (CID 54684039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).