N-benzyl-2-(3-methyl-2-phenylquinolin-4-yl)acetamide

C25H22N2O — CID 139934118

IUPACN-benzyl-2-(3-methyl-2-phenylquinolin-4-yl)acetamide
SMILESCc1c(-c2ccccc2)nc2ccccc2c1CC(=O)NCc1ccccc1
InChIInChI=1S/C25H22N2O/c1-18-22(16-24(28)26-17-19-10-4-2-5-11-19)21-14-8-9-15-23(21)27-25(18)20-12-6-3-7-13-20/h2-15H,16-17H2,1H3,(H,26,28)
InChIKeyRIJPHHCBLBYCCC-UHFFFAOYSA-N
MW366.46 g/mol
LogP5.07
Rot. Bonds5

About N-benzyl-2-(3-methyl-2-phenylquinolin-4-yl)acetamide

N-benzyl-2-(3-methyl-2-phenylquinolin-4-yl)acetamide (PubChem CID 139934118) has the molecular formula C25H22N2O and a molecular weight of 366.46 g/mol. Its IUPAC name is N-benzyl-2-(3-methyl-2-phenylquinolin-4-yl)acetamide.

Molecular Properties

Compound NameN-benzyl-2-(3-methyl-2-phenylquinolin-4-yl)acetamide
PubChem CID139934118
Molecular FormulaC25H22N2O
Molecular Weight366.46 g/mol
Exact Mass366.17
IUPAC NameN-benzyl-2-(3-methyl-2-phenylquinolin-4-yl)acetamide
SMILESCc1c(-c2ccccc2)nc2ccccc2c1CC(=O)NCc1ccccc1
InChIInChI=1S/C25H22N2O/c1-18-22(16-24(28)26-17-19-10-4-2-5-11-19)21-14-8-9-15-23(21)27-25(18)20-12-6-3-7-13-20/h2-15H,16-17H2,1H3,(H,26,28)
InChIKeyRIJPHHCBLBYCCC-UHFFFAOYSA-N
XLogP5.07
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.46
LogP ≤ 55.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-benzyl-2-(3-methyl-2-phenylquinolin-4-yl)acetamide with MolForge

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

Launch Full Analysis

Related Compounds

N-benzyl-3-(methylsulfanylmethyl)-2-phenylquinoline-4-carboxamide;ethane
CID 143429008
ethyl 2-[(3-methyl-2-phenylquinoline-4-carbonyl)amino]acetate
CID 4525423
N-[2-(benzylsulfamoyl)ethyl]-2-(2,4-dimethylquinolin-3-yl)acetamide
CID 55726824
N-(furan-2-ylmethyl)-3-methyl-2-(4-methylphenyl)quinoline-4-carboxamide
CID 4195207
2-(4-methoxyphenyl)-3-methyl-N-(2-phenylethyl)quinoline-4-carboxamide
CID 5197457
2-(4-chlorophenyl)-N-[2-[[2-(4-chlorophenyl)-3-methylquinoline-4-carbonyl]amino]ethyl]-3-methylquinoline-4-carboxamide
CID 4160455
N-benzyl-2-[2-methyl-4-(4-methylphenyl)-1,3-thiazol-5-yl]acetamide
CID 2461104
2-(3-ethyl-2-phenylquinolin-4-yl)acetic acid
CID 21283577
N-benzyl-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide
CID 18194355
[2-(2-methoxyethylamino)-2-oxoethyl] 3-methyl-2-phenylquinoline-4-carboxylate
CID 2096489
N-(2,6-diethylphenyl)-3-methyl-2-phenylquinoline-4-carboxamide
CID 3417174
3-methyl-2-phenylquinoline-4-carboxylic acid;hydrochloride
CID 140991456

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-(3-methyl-2-phenylquinolin-4-yl)acetamide?
The IUPAC name of N-benzyl-2-(3-methyl-2-phenylquinolin-4-yl)acetamide (CID 139934118) is N-benzyl-2-(3-methyl-2-phenylquinolin-4-yl)acetamide.
What is the SMILES notation for N-benzyl-2-(3-methyl-2-phenylquinolin-4-yl)acetamide?
The canonical SMILES for N-benzyl-2-(3-methyl-2-phenylquinolin-4-yl)acetamide is Cc1c(-c2ccccc2)nc2ccccc2c1CC(=O)NCc1ccccc1.
What is the InChIKey of N-benzyl-2-(3-methyl-2-phenylquinolin-4-yl)acetamide?
The InChIKey is RIJPHHCBLBYCCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H22N2O/c1-18-22(16-24(28)26-17-19-10-4-2-5-11-19)21-14-8-9-15-23(21)27-25(18)20-12-6-3-7-13-20/h2-15H,16-17H2,1H3,(H,26,28).
What are the key properties of N-benzyl-2-(3-methyl-2-phenylquinolin-4-yl)acetamide?
N-benzyl-2-(3-methyl-2-phenylquinolin-4-yl)acetamide has a molecular weight of 366.46 g/mol, XLogP of 5.07, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-(3-methyl-2-phenylquinolin-4-yl)acetamide is sourced from PubChem (CID 139934118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).