N-(2,5-dimethoxyphenyl)-2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)butanamide

C23H26N2O5 — CID 46301526

IUPACN-(2,5-dimethoxyphenyl)-2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)butanamide
SMILESCCC(C(=O)Nc1cc(OC)ccc1OC)n1c(=O)cc(C)c2cccc(OC)c21
InChIInChI=1S/C23H26N2O5/c1-6-18(23(27)24-17-13-15(28-3)10-11-19(17)29-4)25-21(26)12-14(2)16-8-7-9-20(30-5)22(16)25/h7-13,18H,6H2,1-5H3,(H,24,27)
InChIKeyPWSQINQYNOBPON-UHFFFAOYSA-N
MW410.47 g/mol
LogP3.93
Rot. Bonds7

About N-(2,5-dimethoxyphenyl)-2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)butanamide

N-(2,5-dimethoxyphenyl)-2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)butanamide (PubChem CID 46301526) has the molecular formula C23H26N2O5 and a molecular weight of 410.47 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)butanamide.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)butanamide
PubChem CID46301526
Molecular FormulaC23H26N2O5
Molecular Weight410.47 g/mol
Exact Mass410.18
IUPAC NameN-(2,5-dimethoxyphenyl)-2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)butanamide
SMILESCCC(C(=O)Nc1cc(OC)ccc1OC)n1c(=O)cc(C)c2cccc(OC)c21
InChIInChI=1S/C23H26N2O5/c1-6-18(23(27)24-17-13-15(28-3)10-11-19(17)29-4)25-21(26)12-14(2)16-8-7-9-20(30-5)22(16)25/h7-13,18H,6H2,1-5H3,(H,24,27)
InChIKeyPWSQINQYNOBPON-UHFFFAOYSA-N
XLogP3.93
TPSA78.79 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.47
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(3,4-dimethylphenyl)-2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)butanamide
CID 46301501
ethyl 5-[2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)butanoylamino]-1-methylpyrazole-4-carboxylate
CID 46301544
N-(4-acetamidophenyl)-2-(4,8-dimethyl-2-oxoquinolin-1-yl)butanamide
CID 46301224
N-(2,5-dimethoxyphenyl)-2-(6-oxo-3-phenylpyridazin-1-yl)butanamide
CID 25249749
N-benzyl-2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)propanamide
CID 46301475
ethyl 3-[2-(4,8-dimethyl-2-oxoquinolin-1-yl)butanoylamino]benzoate
CID 46301226
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(4,8-dimethyl-2-oxoquinolin-1-yl)butanamide
CID 46301204
(2R)-N-(2,5-dimethoxyphenyl)-2-(3,4-dimethylphenoxy)butanamide
CID 28576208
2-(4,8-dimethyl-2-oxoquinolin-1-yl)-N-[3-(trifluoromethyl)phenyl]butanamide
CID 46301245
N-(2,4-dimethoxyphenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)butanamide
CID 4907918
(2,6-dimethoxyphenyl) N-(2,5-dimethoxyphenyl)carbamate
CID 3325255
diethyl 1-[1-(2,5-dimethoxyanilino)-1-oxobutan-2-yl]triazole-4,5-dicarboxylate
CID 20852242

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)-2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)butanamide?
The IUPAC name of N-(2,5-dimethoxyphenyl)-2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)butanamide (CID 46301526) is N-(2,5-dimethoxyphenyl)-2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)butanamide.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)butanamide?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)butanamide is CCC(C(=O)Nc1cc(OC)ccc1OC)n1c(=O)cc(C)c2cccc(OC)c21.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)butanamide?
The InChIKey is PWSQINQYNOBPON-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N2O5/c1-6-18(23(27)24-17-13-15(28-3)10-11-19(17)29-4)25-21(26)12-14(2)16-8-7-9-20(30-5)22(16)25/h7-13,18H,6H2,1-5H3,(H,24,27).
What are the key properties of N-(2,5-dimethoxyphenyl)-2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)butanamide?
N-(2,5-dimethoxyphenyl)-2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)butanamide has a molecular weight of 410.47 g/mol, XLogP of 3.93, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethoxyphenyl)-2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)butanamide is sourced from PubChem (CID 46301526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).