N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[2-(2-methylphenyl)ethyl]acetamide

C22H24N2O2 — CID 1453407

IUPACN-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[2-(2-methylphenyl)ethyl]acetamide
SMILESCC(=O)N(CCc1ccccc1C)Cc1cc2ccc(C)cc2[nH]c1=O
InChIInChI=1S/C22H24N2O2/c1-15-8-9-19-13-20(22(26)23-21(19)12-15)14-24(17(3)25)11-10-18-7-5-4-6-16(18)2/h4-9,12-13H,10-11,14H2,1-3H3,(H,23,26)
InChIKeyVKQKZWMOXWXTSP-UHFFFAOYSA-N
MW348.45 g/mol
LogP3.74
Rot. Bonds5

About N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[2-(2-methylphenyl)ethyl]acetamide

N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[2-(2-methylphenyl)ethyl]acetamide (PubChem CID 1453407) has the molecular formula C22H24N2O2 and a molecular weight of 348.45 g/mol. Its IUPAC name is N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[2-(2-methylphenyl)ethyl]acetamide.

Molecular Properties

Compound NameN-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[2-(2-methylphenyl)ethyl]acetamide
PubChem CID1453407
Molecular FormulaC22H24N2O2
Molecular Weight348.45 g/mol
Exact Mass348.18
IUPAC NameN-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[2-(2-methylphenyl)ethyl]acetamide
SMILESCC(=O)N(CCc1ccccc1C)Cc1cc2ccc(C)cc2[nH]c1=O
InChIInChI=1S/C22H24N2O2/c1-15-8-9-19-13-20(22(26)23-21(19)12-15)14-24(17(3)25)11-10-18-7-5-4-6-16(18)2/h4-9,12-13H,10-11,14H2,1-3H3,(H,23,26)
InChIKeyVKQKZWMOXWXTSP-UHFFFAOYSA-N
XLogP3.74
TPSA53.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.45
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[2-(2-methylphenyl)ethyl]acetamide?
The IUPAC name of N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[2-(2-methylphenyl)ethyl]acetamide (CID 1453407) is N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[2-(2-methylphenyl)ethyl]acetamide.
What is the SMILES notation for N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[2-(2-methylphenyl)ethyl]acetamide?
The canonical SMILES for N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[2-(2-methylphenyl)ethyl]acetamide is CC(=O)N(CCc1ccccc1C)Cc1cc2ccc(C)cc2[nH]c1=O.
What is the InChIKey of N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[2-(2-methylphenyl)ethyl]acetamide?
The InChIKey is VKQKZWMOXWXTSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O2/c1-15-8-9-19-13-20(22(26)23-21(19)12-15)14-24(17(3)25)11-10-18-7-5-4-6-16(18)2/h4-9,12-13H,10-11,14H2,1-3H3,(H,23,26).
What are the key properties of N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[2-(2-methylphenyl)ethyl]acetamide?
N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[2-(2-methylphenyl)ethyl]acetamide has a molecular weight of 348.45 g/mol, XLogP of 3.74, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[2-(2-methylphenyl)ethyl]acetamide is sourced from PubChem (CID 1453407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).