N-(1-benzyl-2-oxo-3,4-dihydroquinolin-6-yl)-3-methylbenzamide

C24H22N2O2 — CID 16926919

IUPACN-(1-benzyl-2-oxo-3,4-dihydroquinolin-6-yl)-3-methylbenzamide
SMILESCc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3Cc2ccccc2)c1
InChIInChI=1S/C24H22N2O2/c1-17-6-5-9-20(14-17)24(28)25-21-11-12-22-19(15-21)10-13-23(27)26(22)16-18-7-3-2-4-8-18/h2-9,11-12,14-15H,10,13,16H2,1H3,(H,25,28)
InChIKeyYYQRDAYKZNBVJM-UHFFFAOYSA-N
MW370.45 g/mol
LogP4.73
Rot. Bonds4

About N-(1-benzyl-2-oxo-3,4-dihydroquinolin-6-yl)-3-methylbenzamide

N-(1-benzyl-2-oxo-3,4-dihydroquinolin-6-yl)-3-methylbenzamide (PubChem CID 16926919) has the molecular formula C24H22N2O2 and a molecular weight of 370.45 g/mol. Its IUPAC name is N-(1-benzyl-2-oxo-3,4-dihydroquinolin-6-yl)-3-methylbenzamide.

Molecular Properties

Compound NameN-(1-benzyl-2-oxo-3,4-dihydroquinolin-6-yl)-3-methylbenzamide
PubChem CID16926919
Molecular FormulaC24H22N2O2
Molecular Weight370.45 g/mol
Exact Mass370.17
IUPAC NameN-(1-benzyl-2-oxo-3,4-dihydroquinolin-6-yl)-3-methylbenzamide
SMILESCc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3Cc2ccccc2)c1
InChIInChI=1S/C24H22N2O2/c1-17-6-5-9-20(14-17)24(28)25-21-11-12-22-19(15-21)10-13-23(27)26(22)16-18-7-3-2-4-8-18/h2-9,11-12,14-15H,10,13,16H2,1H3,(H,25,28)
InChIKeyYYQRDAYKZNBVJM-UHFFFAOYSA-N
XLogP4.73
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.45
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(1-benzyl-2-oxo-3,4-dihydroquinolin-6-yl)-3-methylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(1-benzyl-2-oxo-3,4-dihydroquinolin-6-yl)-3-methylbenzamide?
The IUPAC name of N-(1-benzyl-2-oxo-3,4-dihydroquinolin-6-yl)-3-methylbenzamide (CID 16926919) is N-(1-benzyl-2-oxo-3,4-dihydroquinolin-6-yl)-3-methylbenzamide.
What is the SMILES notation for N-(1-benzyl-2-oxo-3,4-dihydroquinolin-6-yl)-3-methylbenzamide?
The canonical SMILES for N-(1-benzyl-2-oxo-3,4-dihydroquinolin-6-yl)-3-methylbenzamide is Cc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3Cc2ccccc2)c1.
What is the InChIKey of N-(1-benzyl-2-oxo-3,4-dihydroquinolin-6-yl)-3-methylbenzamide?
The InChIKey is YYQRDAYKZNBVJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N2O2/c1-17-6-5-9-20(14-17)24(28)25-21-11-12-22-19(15-21)10-13-23(27)26(22)16-18-7-3-2-4-8-18/h2-9,11-12,14-15H,10,13,16H2,1H3,(H,25,28).
What are the key properties of N-(1-benzyl-2-oxo-3,4-dihydroquinolin-6-yl)-3-methylbenzamide?
N-(1-benzyl-2-oxo-3,4-dihydroquinolin-6-yl)-3-methylbenzamide has a molecular weight of 370.45 g/mol, XLogP of 4.73, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzyl-2-oxo-3,4-dihydroquinolin-6-yl)-3-methylbenzamide is sourced from PubChem (CID 16926919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).