2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(4-propan-2-ylphenyl)-N-propylacetamide

C24H28N2O3 — CID 20861827

IUPAC2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(4-propan-2-ylphenyl)-N-propylacetamide
SMILESCCCN(C(=O)COc1cc(=O)n(C)c2ccccc12)c1ccc(C(C)C)cc1
InChIInChI=1S/C24H28N2O3/c1-5-14-26(19-12-10-18(11-13-19)17(2)3)24(28)16-29-22-15-23(27)25(4)21-9-7-6-8-20(21)22/h6-13,15,17H,5,14,16H2,1-4H3
InChIKeyZMLNCERMIBSXPG-UHFFFAOYSA-N
MW392.50 g/mol
LogP4.48
Rot. Bonds7

About 2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(4-propan-2-ylphenyl)-N-propylacetamide

2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(4-propan-2-ylphenyl)-N-propylacetamide (PubChem CID 20861827) has the molecular formula C24H28N2O3 and a molecular weight of 392.50 g/mol. Its IUPAC name is 2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(4-propan-2-ylphenyl)-N-propylacetamide.

Molecular Properties

Compound Name2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(4-propan-2-ylphenyl)-N-propylacetamide
PubChem CID20861827
Molecular FormulaC24H28N2O3
Molecular Weight392.50 g/mol
Exact Mass392.21
IUPAC Name2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(4-propan-2-ylphenyl)-N-propylacetamide
SMILESCCCN(C(=O)COc1cc(=O)n(C)c2ccccc12)c1ccc(C(C)C)cc1
InChIInChI=1S/C24H28N2O3/c1-5-14-26(19-12-10-18(11-13-19)17(2)3)24(28)16-29-22-15-23(27)25(4)21-9-7-6-8-20(21)22/h6-13,15,17H,5,14,16H2,1-4H3
InChIKeyZMLNCERMIBSXPG-UHFFFAOYSA-N
XLogP4.48
TPSA51.54 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.50
LogP ≤ 54.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(4-propan-2-ylphenyl)-N-propylacetamide?
The IUPAC name of 2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(4-propan-2-ylphenyl)-N-propylacetamide (CID 20861827) is 2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(4-propan-2-ylphenyl)-N-propylacetamide.
What is the SMILES notation for 2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(4-propan-2-ylphenyl)-N-propylacetamide?
The canonical SMILES for 2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(4-propan-2-ylphenyl)-N-propylacetamide is CCCN(C(=O)COc1cc(=O)n(C)c2ccccc12)c1ccc(C(C)C)cc1.
What is the InChIKey of 2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(4-propan-2-ylphenyl)-N-propylacetamide?
The InChIKey is ZMLNCERMIBSXPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N2O3/c1-5-14-26(19-12-10-18(11-13-19)17(2)3)24(28)16-29-22-15-23(27)25(4)21-9-7-6-8-20(21)22/h6-13,15,17H,5,14,16H2,1-4H3.
What are the key properties of 2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(4-propan-2-ylphenyl)-N-propylacetamide?
2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(4-propan-2-ylphenyl)-N-propylacetamide has a molecular weight of 392.50 g/mol, XLogP of 4.48, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(4-propan-2-ylphenyl)-N-propylacetamide is sourced from PubChem (CID 20861827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).