N-(4-methoxyphenyl)-2-(4-methyl-2-oxoquinolin-1-yl)butanamide

C21H22N2O3 — CID 46301055

IUPACN-(4-methoxyphenyl)-2-(4-methyl-2-oxoquinolin-1-yl)butanamide
SMILESCCC(C(=O)Nc1ccc(OC)cc1)n1c(=O)cc(C)c2ccccc21
InChIInChI=1S/C21H22N2O3/c1-4-18(21(25)22-15-9-11-16(26-3)12-10-15)23-19-8-6-5-7-17(19)14(2)13-20(23)24/h5-13,18H,4H2,1-3H3,(H,22,25)
InChIKeyDWDUCFDFJXSCPO-UHFFFAOYSA-N
MW350.42 g/mol
LogP3.91
Rot. Bonds5

About N-(4-methoxyphenyl)-2-(4-methyl-2-oxoquinolin-1-yl)butanamide

N-(4-methoxyphenyl)-2-(4-methyl-2-oxoquinolin-1-yl)butanamide (PubChem CID 46301055) has the molecular formula C21H22N2O3 and a molecular weight of 350.42 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-2-(4-methyl-2-oxoquinolin-1-yl)butanamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-2-(4-methyl-2-oxoquinolin-1-yl)butanamide
PubChem CID46301055
Molecular FormulaC21H22N2O3
Molecular Weight350.42 g/mol
Exact Mass350.16
IUPAC NameN-(4-methoxyphenyl)-2-(4-methyl-2-oxoquinolin-1-yl)butanamide
SMILESCCC(C(=O)Nc1ccc(OC)cc1)n1c(=O)cc(C)c2ccccc21
InChIInChI=1S/C21H22N2O3/c1-4-18(21(25)22-15-9-11-16(26-3)12-10-15)23-19-8-6-5-7-17(19)14(2)13-20(23)24/h5-13,18H,4H2,1-3H3,(H,22,25)
InChIKeyDWDUCFDFJXSCPO-UHFFFAOYSA-N
XLogP3.91
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.42
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-methyl-2-oxoquinolin-1-yl)-N-phenylbutanamide
CID 46301025
N-(4-acetamidophenyl)-2-(4,8-dimethyl-2-oxoquinolin-1-yl)butanamide
CID 46301224
N-(3,4-dimethylphenyl)-2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)butanamide
CID 46301501
2-(4-methyl-2-oxoquinolin-1-yl)-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]butanamide
CID 46301098
N-(2,5-dimethoxyphenyl)-2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)butanamide
CID 46301526
2-(4,8-dimethyl-2-oxoquinolin-1-yl)-N-(3-methylphenyl)butanamide
CID 46301191
ethyl 3-[2-(4,8-dimethyl-2-oxoquinolin-1-yl)butanoylamino]benzoate
CID 46301226
2-(4,8-dimethyl-2-oxoquinolin-1-yl)-N-(2,4,6-trimethylphenyl)butanamide
CID 46301197
N-(3,3-dimethylbutyl)-2-(2-methoxycarbazol-9-yl)butanamide
CID 91483085
2-(4,8-dimethyl-2-oxoquinolin-1-yl)-N-[3-(trifluoromethyl)phenyl]butanamide
CID 46301245
2-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-methoxyphenyl)butanamide
CID 16576209
(2R)-2-hydroxy-N-(4-methoxyphenyl)butanamide
CID 139626636

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-2-(4-methyl-2-oxoquinolin-1-yl)butanamide?
The IUPAC name of N-(4-methoxyphenyl)-2-(4-methyl-2-oxoquinolin-1-yl)butanamide (CID 46301055) is N-(4-methoxyphenyl)-2-(4-methyl-2-oxoquinolin-1-yl)butanamide.
What is the SMILES notation for N-(4-methoxyphenyl)-2-(4-methyl-2-oxoquinolin-1-yl)butanamide?
The canonical SMILES for N-(4-methoxyphenyl)-2-(4-methyl-2-oxoquinolin-1-yl)butanamide is CCC(C(=O)Nc1ccc(OC)cc1)n1c(=O)cc(C)c2ccccc21.
What is the InChIKey of N-(4-methoxyphenyl)-2-(4-methyl-2-oxoquinolin-1-yl)butanamide?
The InChIKey is DWDUCFDFJXSCPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N2O3/c1-4-18(21(25)22-15-9-11-16(26-3)12-10-15)23-19-8-6-5-7-17(19)14(2)13-20(23)24/h5-13,18H,4H2,1-3H3,(H,22,25).
What are the key properties of N-(4-methoxyphenyl)-2-(4-methyl-2-oxoquinolin-1-yl)butanamide?
N-(4-methoxyphenyl)-2-(4-methyl-2-oxoquinolin-1-yl)butanamide has a molecular weight of 350.42 g/mol, XLogP of 3.91, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-2-(4-methyl-2-oxoquinolin-1-yl)butanamide is sourced from PubChem (CID 46301055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).