2-methyl-N-[(2-oxo-1H-quinolin-4-yl)methyl]-N-phenylpropanamide

C20H20N2O2 — CID 664261

IUPAC2-methyl-N-[(2-oxo-1H-quinolin-4-yl)methyl]-N-phenylpropanamide
SMILESCC(C)C(=O)N(Cc1cc(=O)[nH]c2ccccc12)c1ccccc1
InChIInChI=1S/C20H20N2O2/c1-14(2)20(24)22(16-8-4-3-5-9-16)13-15-12-19(23)21-18-11-7-6-10-17(15)18/h3-12,14H,13H2,1-2H3,(H,21,23)
InChIKeyCGDRJAGCDVTZHK-UHFFFAOYSA-N
MW320.39 g/mol
LogP3.72
Rot. Bonds4

About 2-methyl-N-[(2-oxo-1H-quinolin-4-yl)methyl]-N-phenylpropanamide

2-methyl-N-[(2-oxo-1H-quinolin-4-yl)methyl]-N-phenylpropanamide (PubChem CID 664261) has the molecular formula C20H20N2O2 and a molecular weight of 320.39 g/mol. Its IUPAC name is 2-methyl-N-[(2-oxo-1H-quinolin-4-yl)methyl]-N-phenylpropanamide.

Molecular Properties

Compound Name2-methyl-N-[(2-oxo-1H-quinolin-4-yl)methyl]-N-phenylpropanamide
PubChem CID664261
Molecular FormulaC20H20N2O2
Molecular Weight320.39 g/mol
Exact Mass320.15
IUPAC Name2-methyl-N-[(2-oxo-1H-quinolin-4-yl)methyl]-N-phenylpropanamide
SMILESCC(C)C(=O)N(Cc1cc(=O)[nH]c2ccccc12)c1ccccc1
InChIInChI=1S/C20H20N2O2/c1-14(2)20(24)22(16-8-4-3-5-9-16)13-15-12-19(23)21-18-11-7-6-10-17(15)18/h3-12,14H,13H2,1-2H3,(H,21,23)
InChIKeyCGDRJAGCDVTZHK-UHFFFAOYSA-N
XLogP3.72
TPSA53.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2-oxo-1H-quinolin-4-yl)methyl]-N-phenylacetamide
CID 664652
N-(4-methylphenyl)-N-[(2-oxo-1H-quinolin-4-yl)methyl]acetamide
CID 664948
4-methyl-N-[(2-oxo-1H-quinolin-4-yl)methyl]-N-phenyl-1,3-thiazole-5-carboxamide
CID 42618037
N-(4-methoxyphenyl)-4-methyl-N-[(2-oxo-1H-quinolin-4-yl)methyl]benzamide
CID 2031864
4-bromo-N-[(2-oxo-1H-quinolin-4-yl)methyl]-N-propan-2-ylbenzamide
CID 20896805
3-bromo-N-[(2-oxo-1H-quinolin-4-yl)methyl]-N-propan-2-ylbenzamide
CID 20896798
N-(3-chlorophenyl)-N-[(2-oxo-1H-quinolin-4-yl)methyl]furan-2-carboxamide
CID 59740649
3,4,5-trimethoxy-N-[(2-oxo-1H-quinolin-4-yl)methyl]-N-propan-2-ylbenzamide
CID 20896802
2-bromo-N-[(2-oxo-1H-quinolin-4-yl)methyl]propanamide
CID 166383305
methyl-[(2-oxo-1H-quinolin-4-yl)methyl]azanium
CID 7061139
3-(2,5-dimethylphenyl)-1-[(2-oxo-1H-quinolin-4-yl)methyl]-1-propan-2-ylurea
CID 50749328
3-(4-chlorophenyl)-1-(2-methylpropyl)-1-[(2-oxo-1H-quinolin-4-yl)methyl]urea
CID 50749499

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(2-oxo-1H-quinolin-4-yl)methyl]-N-phenylpropanamide?
The IUPAC name of 2-methyl-N-[(2-oxo-1H-quinolin-4-yl)methyl]-N-phenylpropanamide (CID 664261) is 2-methyl-N-[(2-oxo-1H-quinolin-4-yl)methyl]-N-phenylpropanamide.
What is the SMILES notation for 2-methyl-N-[(2-oxo-1H-quinolin-4-yl)methyl]-N-phenylpropanamide?
The canonical SMILES for 2-methyl-N-[(2-oxo-1H-quinolin-4-yl)methyl]-N-phenylpropanamide is CC(C)C(=O)N(Cc1cc(=O)[nH]c2ccccc12)c1ccccc1.
What is the InChIKey of 2-methyl-N-[(2-oxo-1H-quinolin-4-yl)methyl]-N-phenylpropanamide?
The InChIKey is CGDRJAGCDVTZHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O2/c1-14(2)20(24)22(16-8-4-3-5-9-16)13-15-12-19(23)21-18-11-7-6-10-17(15)18/h3-12,14H,13H2,1-2H3,(H,21,23).
What are the key properties of 2-methyl-N-[(2-oxo-1H-quinolin-4-yl)methyl]-N-phenylpropanamide?
2-methyl-N-[(2-oxo-1H-quinolin-4-yl)methyl]-N-phenylpropanamide has a molecular weight of 320.39 g/mol, XLogP of 3.72, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(2-oxo-1H-quinolin-4-yl)methyl]-N-phenylpropanamide is sourced from PubChem (CID 664261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).