N-methoxy-2-oxo-1H-quinoline-3-carboxamide

C11H10N2O3 — CID 13163172

IUPACN-methoxy-2-oxo-1H-quinoline-3-carboxamide
SMILESCONC(=O)c1cc2ccccc2[nH]c1=O
InChIInChI=1S/C11H10N2O3/c1-16-13-11(15)8-6-7-4-2-3-5-9(7)12-10(8)14/h2-6H,1H3,(H,12,14)(H,13,15)
InChIKeyKYWXOTHPWNMUAU-UHFFFAOYSA-N
MW218.21 g/mol
LogP0.82
Rot. Bonds2

About N-methoxy-2-oxo-1H-quinoline-3-carboxamide

N-methoxy-2-oxo-1H-quinoline-3-carboxamide (PubChem CID 13163172) has the molecular formula C11H10N2O3 and a molecular weight of 218.21 g/mol. Its IUPAC name is N-methoxy-2-oxo-1H-quinoline-3-carboxamide.

Molecular Properties

Compound NameN-methoxy-2-oxo-1H-quinoline-3-carboxamide
PubChem CID13163172
Molecular FormulaC11H10N2O3
Molecular Weight218.21 g/mol
Exact Mass218.07
IUPAC NameN-methoxy-2-oxo-1H-quinoline-3-carboxamide
SMILESCONC(=O)c1cc2ccccc2[nH]c1=O
InChIInChI=1S/C11H10N2O3/c1-16-13-11(15)8-6-7-4-2-3-5-9(7)12-10(8)14/h2-6H,1H3,(H,12,14)(H,13,15)
InChIKeyKYWXOTHPWNMUAU-UHFFFAOYSA-N
XLogP0.82
TPSA71.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.21
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-methoxy-2-oxo-1H-quinoline-3-carboxamide?
The IUPAC name of N-methoxy-2-oxo-1H-quinoline-3-carboxamide (CID 13163172) is N-methoxy-2-oxo-1H-quinoline-3-carboxamide.
What is the SMILES notation for N-methoxy-2-oxo-1H-quinoline-3-carboxamide?
The canonical SMILES for N-methoxy-2-oxo-1H-quinoline-3-carboxamide is CONC(=O)c1cc2ccccc2[nH]c1=O.
What is the InChIKey of N-methoxy-2-oxo-1H-quinoline-3-carboxamide?
The InChIKey is KYWXOTHPWNMUAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O3/c1-16-13-11(15)8-6-7-4-2-3-5-9(7)12-10(8)14/h2-6H,1H3,(H,12,14)(H,13,15).
What are the key properties of N-methoxy-2-oxo-1H-quinoline-3-carboxamide?
N-methoxy-2-oxo-1H-quinoline-3-carboxamide has a molecular weight of 218.21 g/mol, XLogP of 0.82, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-2-oxo-1H-quinoline-3-carboxamide is sourced from PubChem (CID 13163172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).