N-(4-chlorophenyl)-2-(2-methylphenyl)quinoline-4-carboxamide

C23H17ClN2O — CID 5069156

IUPACN-(4-chlorophenyl)-2-(2-methylphenyl)quinoline-4-carboxamide
SMILESCc1ccccc1-c1cc(C(=O)Nc2ccc(Cl)cc2)c2ccccc2n1
InChIInChI=1S/C23H17ClN2O/c1-15-6-2-3-7-18(15)22-14-20(19-8-4-5-9-21(19)26-22)23(27)25-17-12-10-16(24)11-13-17/h2-14H,1H3,(H,25,27)
InChIKeyCCNUCDPZABYSKK-UHFFFAOYSA-N
MW372.86 g/mol
LogP6.12
Rot. Bonds3

About N-(4-chlorophenyl)-2-(2-methylphenyl)quinoline-4-carboxamide

N-(4-chlorophenyl)-2-(2-methylphenyl)quinoline-4-carboxamide (PubChem CID 5069156) has the molecular formula C23H17ClN2O and a molecular weight of 372.86 g/mol. Its IUPAC name is N-(4-chlorophenyl)-2-(2-methylphenyl)quinoline-4-carboxamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-2-(2-methylphenyl)quinoline-4-carboxamide
PubChem CID5069156
Molecular FormulaC23H17ClN2O
Molecular Weight372.86 g/mol
Exact Mass372.10
IUPAC NameN-(4-chlorophenyl)-2-(2-methylphenyl)quinoline-4-carboxamide
SMILESCc1ccccc1-c1cc(C(=O)Nc2ccc(Cl)cc2)c2ccccc2n1
InChIInChI=1S/C23H17ClN2O/c1-15-6-2-3-7-18(15)22-14-20(19-8-4-5-9-21(19)26-22)23(27)25-17-12-10-16(24)11-13-17/h2-14H,1H3,(H,25,27)
InChIKeyCCNUCDPZABYSKK-UHFFFAOYSA-N
XLogP6.12
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.86
LogP ≤ 56.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-methylphenyl)-N-[3-[[2-(2-methylphenyl)quinoline-4-carbonyl]amino]phenyl]quinoline-4-carboxamide
CID 3276867
N-(4-chlorophenyl)-2-(2,4-dimethoxyphenyl)quinoline-4-carboxamide
CID 4150006
N-(4-chlorophenyl)-2-(4-fluorophenyl)quinoline-4-carboxamide
CID 3131336
2-(2-chlorophenyl)-N-(2,6-dimethylphenyl)quinoline-4-carboxamide
CID 5128996
N-[4-(2,4-dichlorophenyl)-1,3-thiazol-2-yl]-2-(2-methylphenyl)quinoline-4-carboxamide
CID 3517701
2-(4-chlorophenyl)-N-[4-(dimethylamino)phenyl]quinoline-4-carboxamide
CID 4052341
7-chloro-2-(2-methylphenyl)quinoline-4-carboxylic acid
CID 63462482
2-(2,4-dichlorophenyl)-N-pyridin-4-ylquinoline-4-carboxamide
CID 3601091
N-(4-carbamoylphenyl)-2-(4-chlorophenyl)quinoline-4-carboxamide
CID 1222709
2-(3,4-dimethylphenyl)-N-[4-[[2-(3,4-dimethylphenyl)quinoline-4-carbonyl]amino]phenyl]quinoline-4-carboxamide
CID 4144858
N-(2,4-dichlorophenyl)-2-(2,4-dimethylphenyl)quinoline-4-carboxamide
CID 4306241
N-(4-chloro-2-fluorophenyl)-2-(2,4-dimethylphenyl)quinoline-4-carboxamide
CID 3298781

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-2-(2-methylphenyl)quinoline-4-carboxamide?
The IUPAC name of N-(4-chlorophenyl)-2-(2-methylphenyl)quinoline-4-carboxamide (CID 5069156) is N-(4-chlorophenyl)-2-(2-methylphenyl)quinoline-4-carboxamide.
What is the SMILES notation for N-(4-chlorophenyl)-2-(2-methylphenyl)quinoline-4-carboxamide?
The canonical SMILES for N-(4-chlorophenyl)-2-(2-methylphenyl)quinoline-4-carboxamide is Cc1ccccc1-c1cc(C(=O)Nc2ccc(Cl)cc2)c2ccccc2n1.
What is the InChIKey of N-(4-chlorophenyl)-2-(2-methylphenyl)quinoline-4-carboxamide?
The InChIKey is CCNUCDPZABYSKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17ClN2O/c1-15-6-2-3-7-18(15)22-14-20(19-8-4-5-9-21(19)26-22)23(27)25-17-12-10-16(24)11-13-17/h2-14H,1H3,(H,25,27).
What are the key properties of N-(4-chlorophenyl)-2-(2-methylphenyl)quinoline-4-carboxamide?
N-(4-chlorophenyl)-2-(2-methylphenyl)quinoline-4-carboxamide has a molecular weight of 372.86 g/mol, XLogP of 6.12, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-2-(2-methylphenyl)quinoline-4-carboxamide is sourced from PubChem (CID 5069156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).