(6R)-N-(4-ethoxyphenyl)-6-methyl-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide

C19H22N2O3 — CID 95397492

IUPAC(6R)-N-(4-ethoxyphenyl)-6-methyl-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide
SMILESCCOc1ccc(NC(=O)c2cc3c([nH]c2=O)CC[C@@H](C)C3)cc1
InChIInChI=1S/C19H22N2O3/c1-3-24-15-7-5-14(6-8-15)20-18(22)16-11-13-10-12(2)4-9-17(13)21-19(16)23/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,20,22)(H,21,23)/t12-/m1/s1
InChIKeyJRXFVHZMIJNGKY-GFCCVEGCSA-N
MW326.40 g/mol
LogP3.15
Rot. Bonds4

About (6R)-N-(4-ethoxyphenyl)-6-methyl-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide

(6R)-N-(4-ethoxyphenyl)-6-methyl-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide (PubChem CID 95397492) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is (6R)-N-(4-ethoxyphenyl)-6-methyl-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide.

Molecular Properties

Compound Name(6R)-N-(4-ethoxyphenyl)-6-methyl-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide
PubChem CID95397492
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC Name(6R)-N-(4-ethoxyphenyl)-6-methyl-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide
SMILESCCOc1ccc(NC(=O)c2cc3c([nH]c2=O)CC[C@@H](C)C3)cc1
InChIInChI=1S/C19H22N2O3/c1-3-24-15-7-5-14(6-8-15)20-18(22)16-11-13-10-12(2)4-9-17(13)21-19(16)23/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,20,22)(H,21,23)/t12-/m1/s1
InChIKeyJRXFVHZMIJNGKY-GFCCVEGCSA-N
XLogP3.15
TPSA71.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (6R)-N-(4-ethoxyphenyl)-6-methyl-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide with MolForge

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Related Compounds

N-(4-ethoxyphenyl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide
CID 66497881
N-[3-[(4-ethoxyphenyl)sulfamoyl]-4-methylphenyl]-2,5-dioxo-1,6,7,8-tetrahydroquinoline-3-carboxamide
CID 36865808
2,5-dioxo-N-[4-(2,2,2-trifluoroethoxy)phenyl]-1,6,7,8-tetrahydroquinoline-3-carboxamide
CID 46552704
2-chloro-N-(4-ethoxyphenyl)-5-iodobenzamide
CID 1118900
(7R)-7-methyl-2,5-dioxo-N-(4-propan-2-ylphenyl)-1,6,7,8-tetrahydroquinoline-3-carboxamide
CID 95554626
N-(4-ethoxyphenyl)-2,4,5-trimethoxybenzamide
CID 912703
N-(4-ethoxyphenyl)-5-oxo-1,2-dihydropyrazole-3-carboxamide
CID 110600672
1-cyclopropyl-N-(4-ethoxyphenyl)-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide
CID 36705199
N'-(4-ethoxyphenyl)sulfonyl-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide
CID 78710862
4-ethoxy-N-[4-(3-methylpyrrolidin-1-yl)phenyl]benzamide
CID 56559078
N-(4-ethoxyphenyl)-2-methylbenzamide
CID 710558
N-(4-ethoxy-3-morpholin-4-ylsulfonylphenyl)-6-methyl-6,7,8,9-tetrahydro-5H-carbazole-1-carboxamide
CID 55678676

Frequently Asked Questions

What is the IUPAC name of (6R)-N-(4-ethoxyphenyl)-6-methyl-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide?
The IUPAC name of (6R)-N-(4-ethoxyphenyl)-6-methyl-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide (CID 95397492) is (6R)-N-(4-ethoxyphenyl)-6-methyl-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide.
What is the SMILES notation for (6R)-N-(4-ethoxyphenyl)-6-methyl-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide?
The canonical SMILES for (6R)-N-(4-ethoxyphenyl)-6-methyl-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide is CCOc1ccc(NC(=O)c2cc3c([nH]c2=O)CC[C@@H](C)C3)cc1.
What is the InChIKey of (6R)-N-(4-ethoxyphenyl)-6-methyl-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide?
The InChIKey is JRXFVHZMIJNGKY-GFCCVEGCSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-3-24-15-7-5-14(6-8-15)20-18(22)16-11-13-10-12(2)4-9-17(13)21-19(16)23/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,20,22)(H,21,23)/t12-/m1/s1.
What are the key properties of (6R)-N-(4-ethoxyphenyl)-6-methyl-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide?
(6R)-N-(4-ethoxyphenyl)-6-methyl-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide has a molecular weight of 326.40 g/mol, XLogP of 3.15, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-N-(4-ethoxyphenyl)-6-methyl-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide is sourced from PubChem (CID 95397492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).