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

C23H26N2O2 — CID 24747366

IUPACN-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[2-(2-methylphenyl)ethyl]propanamide
SMILESCCC(=O)N(CCc1ccccc1C)Cc1cc2ccc(C)cc2[nH]c1=O
InChIInChI=1S/C23H26N2O2/c1-4-22(26)25(12-11-18-8-6-5-7-17(18)3)15-20-14-19-10-9-16(2)13-21(19)24-23(20)27/h5-10,13-14H,4,11-12,15H2,1-3H3,(H,24,27)
InChIKeyRQYXIABSTBNXII-UHFFFAOYSA-N
MW362.47 g/mol
LogP4.13
Rot. Bonds6

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

N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[2-(2-methylphenyl)ethyl]propanamide (PubChem CID 24747366) has the molecular formula C23H26N2O2 and a molecular weight of 362.47 g/mol. Its IUPAC name is N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[2-(2-methylphenyl)ethyl]propanamide.

Molecular Properties

Compound NameN-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[2-(2-methylphenyl)ethyl]propanamide
PubChem CID24747366
Molecular FormulaC23H26N2O2
Molecular Weight362.47 g/mol
Exact Mass362.20
IUPAC NameN-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[2-(2-methylphenyl)ethyl]propanamide
SMILESCCC(=O)N(CCc1ccccc1C)Cc1cc2ccc(C)cc2[nH]c1=O
InChIInChI=1S/C23H26N2O2/c1-4-22(26)25(12-11-18-8-6-5-7-17(18)3)15-20-14-19-10-9-16(2)13-21(19)24-23(20)27/h5-10,13-14H,4,11-12,15H2,1-3H3,(H,24,27)
InChIKeyRQYXIABSTBNXII-UHFFFAOYSA-N
XLogP4.13
TPSA53.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.47
LogP ≤ 54.13
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]propanamide?
The IUPAC name of N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[2-(2-methylphenyl)ethyl]propanamide (CID 24747366) is N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[2-(2-methylphenyl)ethyl]propanamide.
What is the SMILES notation for N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[2-(2-methylphenyl)ethyl]propanamide?
The canonical SMILES for N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[2-(2-methylphenyl)ethyl]propanamide is CCC(=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]propanamide?
The InChIKey is RQYXIABSTBNXII-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N2O2/c1-4-22(26)25(12-11-18-8-6-5-7-17(18)3)15-20-14-19-10-9-16(2)13-21(19)24-23(20)27/h5-10,13-14H,4,11-12,15H2,1-3H3,(H,24,27).
What are the key properties of N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[2-(2-methylphenyl)ethyl]propanamide?
N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[2-(2-methylphenyl)ethyl]propanamide has a molecular weight of 362.47 g/mol, XLogP of 4.13, 6 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]propanamide is sourced from PubChem (CID 24747366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).