N-[1-(4-methylphenyl)propyl]-2-phenylquinoline-4-carboxamide

C26H24N2O — CID 3306619

IUPACN-[1-(4-methylphenyl)propyl]-2-phenylquinoline-4-carboxamide
SMILESCCC(NC(=O)c1cc(-c2ccccc2)nc2ccccc12)c1ccc(C)cc1
InChIInChI=1S/C26H24N2O/c1-3-23(20-15-13-18(2)14-16-20)28-26(29)22-17-25(19-9-5-4-6-10-19)27-24-12-8-7-11-21(22)24/h4-17,23H,3H2,1-2H3,(H,28,29)
InChIKeyRLJOSVXGCGGTTB-UHFFFAOYSA-N
MW380.49 g/mol
LogP6.09
Rot. Bonds5

About N-[1-(4-methylphenyl)propyl]-2-phenylquinoline-4-carboxamide

N-[1-(4-methylphenyl)propyl]-2-phenylquinoline-4-carboxamide (PubChem CID 3306619) has the molecular formula C26H24N2O and a molecular weight of 380.49 g/mol. Its IUPAC name is N-[1-(4-methylphenyl)propyl]-2-phenylquinoline-4-carboxamide.

Molecular Properties

Compound NameN-[1-(4-methylphenyl)propyl]-2-phenylquinoline-4-carboxamide
PubChem CID3306619
Molecular FormulaC26H24N2O
Molecular Weight380.49 g/mol
Exact Mass380.19
IUPAC NameN-[1-(4-methylphenyl)propyl]-2-phenylquinoline-4-carboxamide
SMILESCCC(NC(=O)c1cc(-c2ccccc2)nc2ccccc12)c1ccc(C)cc1
InChIInChI=1S/C26H24N2O/c1-3-23(20-15-13-18(2)14-16-20)28-26(29)22-17-25(19-9-5-4-6-10-19)27-24-12-8-7-11-21(22)24/h4-17,23H,3H2,1-2H3,(H,28,29)
InChIKeyRLJOSVXGCGGTTB-UHFFFAOYSA-N
XLogP6.09
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500380.49
LogP ≤ 56.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[1-(4-methylphenyl)propyl]-2-phenylquinoline-4-carboxamide 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

2-(3-fluorophenyl)-N-[(1S)-1-phenylpropyl]quinoline-4-carboxamide
CID 11646686
N-(3-hydroxy-1-phenylpropyl)-2-phenylquinoline-4-carboxamide
CID 10714925
2-(1-ethylpyrazol-4-yl)-N-(1-phenylpropyl)quinoline-4-carboxamide
CID 19518623
N-[(1R)-2-(1,3-dioxoisoindol-2-yl)-1-phenylethyl]-2-phenylquinoline-4-carboxamide
CID 10577234
2-(4-butan-2-ylphenyl)quinoline-4-carboxylic acid
CID 3796863
N-[1-(4-methylphenyl)propyl]-4-phenylbenzamide
CID 17328245
N-[(1R)-1-(3,4-dimethoxyphenyl)ethyl]-2-phenylquinoline-4-carboxamide
CID 2220812
methyl (2R)-2-phenyl-2-[(2-phenylquinoline-4-carbonyl)amino]acetate
CID 6604858
N-[2,2-dimethyl-3-[[2-(4-methylphenyl)quinoline-4-carbonyl]amino]propyl]-2-(4-methylphenyl)quinoline-4-carboxamide
CID 2334871
[2-[[(1R)-1-(4-methylphenyl)propyl]amino]-2-oxoethyl] 2-chloroquinoline-4-carboxylate
CID 9009329
N-[2-(dimethylamino)-2-oxo-1-phenylethyl]-2-phenylquinoline-4-carboxamide
CID 10621487
2,4-dioxo-7-phenyl-N-(1-phenylpropyl)-1H-pyrido[2,3-d]pyrimidine-5-carboxamide
CID 10597112

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methylphenyl)propyl]-2-phenylquinoline-4-carboxamide?
The IUPAC name of N-[1-(4-methylphenyl)propyl]-2-phenylquinoline-4-carboxamide (CID 3306619) is N-[1-(4-methylphenyl)propyl]-2-phenylquinoline-4-carboxamide.
What is the SMILES notation for N-[1-(4-methylphenyl)propyl]-2-phenylquinoline-4-carboxamide?
The canonical SMILES for N-[1-(4-methylphenyl)propyl]-2-phenylquinoline-4-carboxamide is CCC(NC(=O)c1cc(-c2ccccc2)nc2ccccc12)c1ccc(C)cc1.
What is the InChIKey of N-[1-(4-methylphenyl)propyl]-2-phenylquinoline-4-carboxamide?
The InChIKey is RLJOSVXGCGGTTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24N2O/c1-3-23(20-15-13-18(2)14-16-20)28-26(29)22-17-25(19-9-5-4-6-10-19)27-24-12-8-7-11-21(22)24/h4-17,23H,3H2,1-2H3,(H,28,29).
What are the key properties of N-[1-(4-methylphenyl)propyl]-2-phenylquinoline-4-carboxamide?
N-[1-(4-methylphenyl)propyl]-2-phenylquinoline-4-carboxamide has a molecular weight of 380.49 g/mol, XLogP of 6.09, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methylphenyl)propyl]-2-phenylquinoline-4-carboxamide is sourced from PubChem (CID 3306619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).