2-(4,8-dimethyl-2-oxoquinolin-1-yl)-N-(2-ethoxyphenyl)butanamide

C23H26N2O3 — CID 46301214

IUPAC2-(4,8-dimethyl-2-oxoquinolin-1-yl)-N-(2-ethoxyphenyl)butanamide
SMILESCCOc1ccccc1NC(=O)C(CC)n1c(=O)cc(C)c2cccc(C)c21
InChIInChI=1S/C23H26N2O3/c1-5-19(23(27)24-18-12-7-8-13-20(18)28-6-2)25-21(26)14-16(4)17-11-9-10-15(3)22(17)25/h7-14,19H,5-6H2,1-4H3,(H,24,27)
InChIKeyVKUWZPNMQJXQIR-UHFFFAOYSA-N
MW378.47 g/mol
LogP4.61
Rot. Bonds6

About 2-(4,8-dimethyl-2-oxoquinolin-1-yl)-N-(2-ethoxyphenyl)butanamide

2-(4,8-dimethyl-2-oxoquinolin-1-yl)-N-(2-ethoxyphenyl)butanamide (PubChem CID 46301214) has the molecular formula C23H26N2O3 and a molecular weight of 378.47 g/mol. Its IUPAC name is 2-(4,8-dimethyl-2-oxoquinolin-1-yl)-N-(2-ethoxyphenyl)butanamide.

Molecular Properties

Compound Name2-(4,8-dimethyl-2-oxoquinolin-1-yl)-N-(2-ethoxyphenyl)butanamide
PubChem CID46301214
Molecular FormulaC23H26N2O3
Molecular Weight378.47 g/mol
Exact Mass378.19
IUPAC Name2-(4,8-dimethyl-2-oxoquinolin-1-yl)-N-(2-ethoxyphenyl)butanamide
SMILESCCOc1ccccc1NC(=O)C(CC)n1c(=O)cc(C)c2cccc(C)c21
InChIInChI=1S/C23H26N2O3/c1-5-19(23(27)24-18-12-7-8-13-20(18)28-6-2)25-21(26)14-16(4)17-11-9-10-15(3)22(17)25/h7-14,19H,5-6H2,1-4H3,(H,24,27)
InChIKeyVKUWZPNMQJXQIR-UHFFFAOYSA-N
XLogP4.61
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.47
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-acetamidophenyl)-2-(4,8-dimethyl-2-oxoquinolin-1-yl)butanamide
CID 46301224
ethyl 5-[2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)butanoylamino]-1-methylpyrazole-4-carboxylate
CID 46301544
2-(4-methyl-2-oxoquinolin-1-yl)-N-phenylbutanamide
CID 46301025
(2R)-N-(2-ethoxyphenyl)-2-(2-methylphenoxy)propanamide
CID 837498
2-(2-ethoxy-3-oxopyrido[2,3-b]pyrazin-4-yl)-N-(2-ethoxyphenyl)butanamide
CID 50794209
(2S)-2-amino-N-(2-ethoxyphenyl)butanamide
CID 79025438
(2R)-2-(4,8-dimethyl-1-oxo-[1,2,4]triazino[4,5-a]indol-2-yl)-N-(2-ethoxyphenyl)butanamide
CID 92716649
2-(2,6-dimethylphenoxy)-N-(2-ethoxyphenyl)acetamide
CID 834898
N-(2-ethoxyphenyl)-2-(2-methylphenyl)sulfanylpropanamide
CID 60561490
1-[2-(2,6-dimethylphenoxy)ethyl]-3-(2-ethoxyphenyl)urea
CID 112973367
4-(2-ethoxyanilino)-2,3-dimethyl-4-oxobutanoic acid
CID 103496044
N'-(2-ethoxyphenyl)-N-(2-methylphenyl)propanediamide
CID 108952937

Frequently Asked Questions

What is the IUPAC name of 2-(4,8-dimethyl-2-oxoquinolin-1-yl)-N-(2-ethoxyphenyl)butanamide?
The IUPAC name of 2-(4,8-dimethyl-2-oxoquinolin-1-yl)-N-(2-ethoxyphenyl)butanamide (CID 46301214) is 2-(4,8-dimethyl-2-oxoquinolin-1-yl)-N-(2-ethoxyphenyl)butanamide.
What is the SMILES notation for 2-(4,8-dimethyl-2-oxoquinolin-1-yl)-N-(2-ethoxyphenyl)butanamide?
The canonical SMILES for 2-(4,8-dimethyl-2-oxoquinolin-1-yl)-N-(2-ethoxyphenyl)butanamide is CCOc1ccccc1NC(=O)C(CC)n1c(=O)cc(C)c2cccc(C)c21.
What is the InChIKey of 2-(4,8-dimethyl-2-oxoquinolin-1-yl)-N-(2-ethoxyphenyl)butanamide?
The InChIKey is VKUWZPNMQJXQIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N2O3/c1-5-19(23(27)24-18-12-7-8-13-20(18)28-6-2)25-21(26)14-16(4)17-11-9-10-15(3)22(17)25/h7-14,19H,5-6H2,1-4H3,(H,24,27).
What are the key properties of 2-(4,8-dimethyl-2-oxoquinolin-1-yl)-N-(2-ethoxyphenyl)butanamide?
2-(4,8-dimethyl-2-oxoquinolin-1-yl)-N-(2-ethoxyphenyl)butanamide has a molecular weight of 378.47 g/mol, XLogP of 4.61, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,8-dimethyl-2-oxoquinolin-1-yl)-N-(2-ethoxyphenyl)butanamide is sourced from PubChem (CID 46301214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).