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

C23H16Cl2N2O — CID 7914734

IUPACN-(4-chloro-2-methylphenyl)-2-(4-chlorophenyl)quinoline-4-carboxamide
SMILESCc1cc(Cl)ccc1NC(=O)c1cc(-c2ccc(Cl)cc2)nc2ccccc12
InChIInChI=1S/C23H16Cl2N2O/c1-14-12-17(25)10-11-20(14)27-23(28)19-13-22(15-6-8-16(24)9-7-15)26-21-5-3-2-4-18(19)21/h2-13H,1H3,(H,27,28)
InChIKeyUNFWVGJJDSNJSD-UHFFFAOYSA-N
MW407.30 g/mol
LogP6.77
Rot. Bonds3

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

N-(4-chloro-2-methylphenyl)-2-(4-chlorophenyl)quinoline-4-carboxamide (PubChem CID 7914734) has the molecular formula C23H16Cl2N2O and a molecular weight of 407.30 g/mol. Its IUPAC name is N-(4-chloro-2-methylphenyl)-2-(4-chlorophenyl)quinoline-4-carboxamide.

Molecular Properties

Compound NameN-(4-chloro-2-methylphenyl)-2-(4-chlorophenyl)quinoline-4-carboxamide
PubChem CID7914734
Molecular FormulaC23H16Cl2N2O
Molecular Weight407.30 g/mol
Exact Mass406.06
IUPAC NameN-(4-chloro-2-methylphenyl)-2-(4-chlorophenyl)quinoline-4-carboxamide
SMILESCc1cc(Cl)ccc1NC(=O)c1cc(-c2ccc(Cl)cc2)nc2ccccc12
InChIInChI=1S/C23H16Cl2N2O/c1-14-12-17(25)10-11-20(14)27-23(28)19-13-22(15-6-8-16(24)9-7-15)26-21-5-3-2-4-18(19)21/h2-13H,1H3,(H,27,28)
InChIKeyUNFWVGJJDSNJSD-UHFFFAOYSA-N
XLogP6.77
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500407.30
LogP ≤ 56.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-chloro-2-methylphenyl)-2-phenylquinoline-4-carboxamide
CID 2923025
N-(2,4-dimethylphenyl)-2-phenylquinoline-4-carboxamide
CID 3480982
2-(4-chlorophenyl)-N-(2-methylnaphthalen-1-yl)quinoline-4-carboxamide
CID 3165622
2-(4-chlorophenyl)-N-(2,4-difluorophenyl)quinoline-4-carboxamide
CID 2165659
N-(2,4-dichlorophenyl)-2-(3,4-dichlorophenyl)quinoline-4-carboxamide
CID 3264826
N-(2-methylphenyl)-2-phenylquinoline-4-carboxamide
CID 769490
N-(4-chloro-2-fluorophenyl)-2-(3-methylphenyl)quinoline-4-carboxamide
CID 4196964
N-(5-chloro-2-hydroxyphenyl)-2-phenylquinoline-4-carboxamide
CID 1310618
N-(4-acetamido-3-chlorophenyl)-2-(4-methylphenyl)quinoline-4-carboxamide
CID 25470751
2-(4-chlorophenyl)-N-(2,5-dimethylpyrazol-3-yl)quinoline-4-carboxamide
CID 52548004
N-(4-chloro-2-fluorophenyl)-2-(2,4-dimethylphenyl)quinoline-4-carboxamide
CID 3298781
N-(2,4-dichlorophenyl)-2-(2,4-dimethylphenyl)quinoline-4-carboxamide
CID 4306241

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-methylphenyl)-2-(4-chlorophenyl)quinoline-4-carboxamide?
The IUPAC name of N-(4-chloro-2-methylphenyl)-2-(4-chlorophenyl)quinoline-4-carboxamide (CID 7914734) is N-(4-chloro-2-methylphenyl)-2-(4-chlorophenyl)quinoline-4-carboxamide.
What is the SMILES notation for N-(4-chloro-2-methylphenyl)-2-(4-chlorophenyl)quinoline-4-carboxamide?
The canonical SMILES for N-(4-chloro-2-methylphenyl)-2-(4-chlorophenyl)quinoline-4-carboxamide is Cc1cc(Cl)ccc1NC(=O)c1cc(-c2ccc(Cl)cc2)nc2ccccc12.
What is the InChIKey of N-(4-chloro-2-methylphenyl)-2-(4-chlorophenyl)quinoline-4-carboxamide?
The InChIKey is UNFWVGJJDSNJSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16Cl2N2O/c1-14-12-17(25)10-11-20(14)27-23(28)19-13-22(15-6-8-16(24)9-7-15)26-21-5-3-2-4-18(19)21/h2-13H,1H3,(H,27,28).
What are the key properties of N-(4-chloro-2-methylphenyl)-2-(4-chlorophenyl)quinoline-4-carboxamide?
N-(4-chloro-2-methylphenyl)-2-(4-chlorophenyl)quinoline-4-carboxamide has a molecular weight of 407.30 g/mol, XLogP of 6.77, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2-methylphenyl)-2-(4-chlorophenyl)quinoline-4-carboxamide is sourced from PubChem (CID 7914734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).