N-(2-methylphenyl)-2-phenylquinoline-4-carboxamide

C23H18N2O — CID 769490

IUPACN-(2-methylphenyl)-2-phenylquinoline-4-carboxamide
SMILESCc1ccccc1NC(=O)c1cc(-c2ccccc2)nc2ccccc12
InChIInChI=1S/C23H18N2O/c1-16-9-5-7-13-20(16)25-23(26)19-15-22(17-10-3-2-4-11-17)24-21-14-8-6-12-18(19)21/h2-15H,1H3,(H,25,26)
InChIKeyPTWFQLUPPGIDEL-UHFFFAOYSA-N
MW338.41 g/mol
LogP5.46
Rot. Bonds3

About N-(2-methylphenyl)-2-phenylquinoline-4-carboxamide

N-(2-methylphenyl)-2-phenylquinoline-4-carboxamide (PubChem CID 769490) has the molecular formula C23H18N2O and a molecular weight of 338.41 g/mol. Its IUPAC name is N-(2-methylphenyl)-2-phenylquinoline-4-carboxamide.

Molecular Properties

Compound NameN-(2-methylphenyl)-2-phenylquinoline-4-carboxamide
PubChem CID769490
Molecular FormulaC23H18N2O
Molecular Weight338.41 g/mol
Exact Mass338.14
IUPAC NameN-(2-methylphenyl)-2-phenylquinoline-4-carboxamide
SMILESCc1ccccc1NC(=O)c1cc(-c2ccccc2)nc2ccccc12
InChIInChI=1S/C23H18N2O/c1-16-9-5-7-13-20(16)25-23(26)19-15-22(17-10-3-2-4-11-17)24-21-14-8-6-12-18(19)21/h2-15H,1H3,(H,25,26)
InChIKeyPTWFQLUPPGIDEL-UHFFFAOYSA-N
XLogP5.46
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.41
LogP ≤ 55.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-acetamidophenyl)-N-(2-methylphenyl)quinoline-4-carboxamide
CID 50816172
N-(2,4-dimethylphenyl)-2-phenylquinoline-4-carboxamide
CID 3480982
N-(2,3-dimethylphenyl)-2-(4-phenylphenyl)quinoline-4-carboxamide
CID 5129728
2-(3-methoxyphenyl)-N-(2-methylphenyl)quinoline-4-carboxamide
CID 1220289
N-(4-chloro-2-methylphenyl)-2-phenylquinoline-4-carboxamide
CID 2923025
2-amino-N-(2-methylphenyl)quinoline-4-carboxamide
CID 62154395
N-(4-chloro-2-methylphenyl)-2-(4-chlorophenyl)quinoline-4-carboxamide
CID 7914734
N-(2-bromophenyl)-2-(3-methylphenyl)quinoline-4-carboxamide
CID 4159405
N-(2,3-dimethylphenyl)-2-(4-ethylphenyl)quinoline-4-carboxamide
CID 5141329
4-methyl-3-[[2-(4-methylphenyl)quinoline-4-carbonyl]amino]benzoate
CID 5081114
N-(2-carbamoylphenyl)-2-(3-methylphenyl)quinoline-4-carboxamide
CID 2886854
2-(2,4-dimethylphenyl)-N-[2-[[2-(2,4-dimethylphenyl)quinoline-4-carbonyl]amino]phenyl]quinoline-4-carboxamide
CID 4178944

Frequently Asked Questions

What is the IUPAC name of N-(2-methylphenyl)-2-phenylquinoline-4-carboxamide?
The IUPAC name of N-(2-methylphenyl)-2-phenylquinoline-4-carboxamide (CID 769490) is N-(2-methylphenyl)-2-phenylquinoline-4-carboxamide.
What is the SMILES notation for N-(2-methylphenyl)-2-phenylquinoline-4-carboxamide?
The canonical SMILES for N-(2-methylphenyl)-2-phenylquinoline-4-carboxamide is Cc1ccccc1NC(=O)c1cc(-c2ccccc2)nc2ccccc12.
What is the InChIKey of N-(2-methylphenyl)-2-phenylquinoline-4-carboxamide?
The InChIKey is PTWFQLUPPGIDEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N2O/c1-16-9-5-7-13-20(16)25-23(26)19-15-22(17-10-3-2-4-11-17)24-21-14-8-6-12-18(19)21/h2-15H,1H3,(H,25,26).
What are the key properties of N-(2-methylphenyl)-2-phenylquinoline-4-carboxamide?
N-(2-methylphenyl)-2-phenylquinoline-4-carboxamide has a molecular weight of 338.41 g/mol, XLogP of 5.46, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylphenyl)-2-phenylquinoline-4-carboxamide is sourced from PubChem (CID 769490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).