N-(2,4-dimethoxyphenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide

C21H22N2O4 — CID 39763982

IUPACN-(2,4-dimethoxyphenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide
SMILESCOc1ccc(NC(=O)CCn2c(=O)cc(C)c3ccccc32)c(OC)c1
InChIInChI=1S/C21H22N2O4/c1-14-12-21(25)23(18-7-5-4-6-16(14)18)11-10-20(24)22-17-9-8-15(26-2)13-19(17)27-3/h4-9,12-13H,10-11H2,1-3H3,(H,22,24)
InChIKeyCNMVYVSNIBMRLI-UHFFFAOYSA-N
MW366.42 g/mol
LogP3.36
Rot. Bonds6

About N-(2,4-dimethoxyphenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide

N-(2,4-dimethoxyphenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide (PubChem CID 39763982) has the molecular formula C21H22N2O4 and a molecular weight of 366.42 g/mol. Its IUPAC name is N-(2,4-dimethoxyphenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide.

Molecular Properties

Compound NameN-(2,4-dimethoxyphenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide
PubChem CID39763982
Molecular FormulaC21H22N2O4
Molecular Weight366.42 g/mol
Exact Mass366.16
IUPAC NameN-(2,4-dimethoxyphenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide
SMILESCOc1ccc(NC(=O)CCn2c(=O)cc(C)c3ccccc32)c(OC)c1
InChIInChI=1S/C21H22N2O4/c1-14-12-21(25)23(18-7-5-4-6-16(14)18)11-10-20(24)22-17-9-8-15(26-2)13-19(17)27-3/h4-9,12-13H,10-11H2,1-3H3,(H,22,24)
InChIKeyCNMVYVSNIBMRLI-UHFFFAOYSA-N
XLogP3.36
TPSA69.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.42
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,4-dimethoxyphenyl)-3-(2,5-dimethylpyrrol-1-yl)propanamide
CID 110689020
N-(2-ethylphenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide
CID 39763926
3-(4-methyl-2-oxoquinolin-1-yl)-N-phenylpropanamide
CID 39763922
N-(2,4-dimethoxyphenyl)-4-(2-methyl-9-oxoacridin-10-yl)butanamide
CID 22330317
N-(2,4-dimethoxyphenyl)-2-(3-methyl-2,4-dioxoquinazolin-1-yl)acetamide
CID 6502390
N-(2,5-dichlorophenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide
CID 39763973
N-(2,4-dimethoxyphenyl)-2-[2-oxo-4-(piperidine-1-carbonyl)quinolin-1-yl]acetamide
CID 17251089
4-methyl-1-(3-oxobutyl)quinolin-2-one
CID 919960
N-(2,3-dimethylphenyl)-3-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)propanamide
CID 39765349
N-(2,4-dimethoxyphenyl)-4-(2-methylphenyl)-4-oxobutanamide
CID 110423070
N-(2,4-dimethoxyphenyl)-2-(3-methyl-1-oxoisoquinolin-2-yl)acetamide
CID 5058844
3-[3-acetyl-5-(4-methoxyphenyl)-2-methylpyrrol-1-yl]-N-(2,4-dimethoxyphenyl)propanamide
CID 46374782

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethoxyphenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide?
The IUPAC name of N-(2,4-dimethoxyphenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide (CID 39763982) is N-(2,4-dimethoxyphenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide.
What is the SMILES notation for N-(2,4-dimethoxyphenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide?
The canonical SMILES for N-(2,4-dimethoxyphenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide is COc1ccc(NC(=O)CCn2c(=O)cc(C)c3ccccc32)c(OC)c1.
What is the InChIKey of N-(2,4-dimethoxyphenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide?
The InChIKey is CNMVYVSNIBMRLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N2O4/c1-14-12-21(25)23(18-7-5-4-6-16(14)18)11-10-20(24)22-17-9-8-15(26-2)13-19(17)27-3/h4-9,12-13H,10-11H2,1-3H3,(H,22,24).
What are the key properties of N-(2,4-dimethoxyphenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide?
N-(2,4-dimethoxyphenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide has a molecular weight of 366.42 g/mol, XLogP of 3.36, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethoxyphenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide is sourced from PubChem (CID 39763982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).