N-(2-ethoxyphenyl)-1-methyl-2-oxoquinoline-4-carboxamide

C19H18N2O3 — CID 110694536

IUPACN-(2-ethoxyphenyl)-1-methyl-2-oxoquinoline-4-carboxamide
SMILESCCOc1ccccc1NC(=O)c1cc(=O)n(C)c2ccccc12
InChIInChI=1S/C19H18N2O3/c1-3-24-17-11-7-5-9-15(17)20-19(23)14-12-18(22)21(2)16-10-6-4-8-13(14)16/h4-12H,3H2,1-2H3,(H,20,23)
InChIKeyGHQIEEKATSFJBC-UHFFFAOYSA-N
MW322.36 g/mol
LogP3.19
Rot. Bonds4

About N-(2-ethoxyphenyl)-1-methyl-2-oxoquinoline-4-carboxamide

N-(2-ethoxyphenyl)-1-methyl-2-oxoquinoline-4-carboxamide (PubChem CID 110694536) has the molecular formula C19H18N2O3 and a molecular weight of 322.36 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-1-methyl-2-oxoquinoline-4-carboxamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-1-methyl-2-oxoquinoline-4-carboxamide
PubChem CID110694536
Molecular FormulaC19H18N2O3
Molecular Weight322.36 g/mol
Exact Mass322.13
IUPAC NameN-(2-ethoxyphenyl)-1-methyl-2-oxoquinoline-4-carboxamide
SMILESCCOc1ccccc1NC(=O)c1cc(=O)n(C)c2ccccc12
InChIInChI=1S/C19H18N2O3/c1-3-24-17-11-7-5-9-15(17)20-19(23)14-12-18(22)21(2)16-10-6-4-8-13(14)16/h4-12H,3H2,1-2H3,(H,20,23)
InChIKeyGHQIEEKATSFJBC-UHFFFAOYSA-N
XLogP3.19
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.36
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-1-methyl-2-oxoquinoline-4-carboxamide?
The IUPAC name of N-(2-ethoxyphenyl)-1-methyl-2-oxoquinoline-4-carboxamide (CID 110694536) is N-(2-ethoxyphenyl)-1-methyl-2-oxoquinoline-4-carboxamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-1-methyl-2-oxoquinoline-4-carboxamide?
The canonical SMILES for N-(2-ethoxyphenyl)-1-methyl-2-oxoquinoline-4-carboxamide is CCOc1ccccc1NC(=O)c1cc(=O)n(C)c2ccccc12.
What is the InChIKey of N-(2-ethoxyphenyl)-1-methyl-2-oxoquinoline-4-carboxamide?
The InChIKey is GHQIEEKATSFJBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O3/c1-3-24-17-11-7-5-9-15(17)20-19(23)14-12-18(22)21(2)16-10-6-4-8-13(14)16/h4-12H,3H2,1-2H3,(H,20,23).
What are the key properties of N-(2-ethoxyphenyl)-1-methyl-2-oxoquinoline-4-carboxamide?
N-(2-ethoxyphenyl)-1-methyl-2-oxoquinoline-4-carboxamide has a molecular weight of 322.36 g/mol, XLogP of 3.19, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-1-methyl-2-oxoquinoline-4-carboxamide is sourced from PubChem (CID 110694536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).