N-(2,6-dichlorophenyl)-2-phenylquinoline-4-carboxamide

C22H14Cl2N2O — CID 2259441

IUPACN-(2,6-dichlorophenyl)-2-phenylquinoline-4-carboxamide
SMILESO=C(Nc1c(Cl)cccc1Cl)c1cc(-c2ccccc2)nc2ccccc12
InChIInChI=1S/C22H14Cl2N2O/c23-17-10-6-11-18(24)21(17)26-22(27)16-13-20(14-7-2-1-3-8-14)25-19-12-5-4-9-15(16)19/h1-13H,(H,26,27)
InChIKeyNFZJTFJQWQYOMM-UHFFFAOYSA-N
MW393.27 g/mol
LogP6.46
Rot. Bonds3

About N-(2,6-dichlorophenyl)-2-phenylquinoline-4-carboxamide

N-(2,6-dichlorophenyl)-2-phenylquinoline-4-carboxamide (PubChem CID 2259441) has the molecular formula C22H14Cl2N2O and a molecular weight of 393.27 g/mol. Its IUPAC name is N-(2,6-dichlorophenyl)-2-phenylquinoline-4-carboxamide.

Molecular Properties

Compound NameN-(2,6-dichlorophenyl)-2-phenylquinoline-4-carboxamide
PubChem CID2259441
Molecular FormulaC22H14Cl2N2O
Molecular Weight393.27 g/mol
Exact Mass392.05
IUPAC NameN-(2,6-dichlorophenyl)-2-phenylquinoline-4-carboxamide
SMILESO=C(Nc1c(Cl)cccc1Cl)c1cc(-c2ccccc2)nc2ccccc12
InChIInChI=1S/C22H14Cl2N2O/c23-17-10-6-11-18(24)21(17)26-22(27)16-13-20(14-7-2-1-3-8-14)25-19-12-5-4-9-15(16)19/h1-13H,(H,26,27)
InChIKeyNFZJTFJQWQYOMM-UHFFFAOYSA-N
XLogP6.46
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500393.27
LogP ≤ 56.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,6-dichlorophenyl)-2-(4-ethoxyphenyl)quinoline-4-carboxamide
CID 4278019
N-(3,4-dichlorophenyl)-2-pyridin-4-ylquinoline-4-carboxamide
CID 2339769
2-(2-chlorophenyl)-N-(2,6-dimethylphenyl)quinoline-4-carboxamide
CID 5128996
N-(2,6-dichlorophenyl)-2-(1,3-dimethylpyrazol-4-yl)quinoline-4-carboxamide
CID 19511727
N-(5-chloro-2-hydroxyphenyl)-2-phenylquinoline-4-carboxamide
CID 1310618
N-(4-chloro-2-methylphenyl)-2-phenylquinoline-4-carboxamide
CID 2923025
N-(2-methylphenyl)-2-phenylquinoline-4-carboxamide
CID 769490
2-(4-chlorophenyl)-N-(2-methylnaphthalen-1-yl)quinoline-4-carboxamide
CID 3165622
N-(2,4-dichlorophenyl)-2-(3,4-dichlorophenyl)quinoline-4-carboxamide
CID 3264826
2-(3-bromophenyl)-N-(2,3,4,5,6-pentafluorophenyl)quinoline-4-carboxamide
CID 3535880
N-(4-chloro-2-methoxy-5-methylphenyl)-2-phenylquinoline-4-carboxamide
CID 1328482
N-(4-chloro-2-fluorophenyl)-2-(3-methylphenyl)quinoline-4-carboxamide
CID 4196964

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dichlorophenyl)-2-phenylquinoline-4-carboxamide?
The IUPAC name of N-(2,6-dichlorophenyl)-2-phenylquinoline-4-carboxamide (CID 2259441) is N-(2,6-dichlorophenyl)-2-phenylquinoline-4-carboxamide.
What is the SMILES notation for N-(2,6-dichlorophenyl)-2-phenylquinoline-4-carboxamide?
The canonical SMILES for N-(2,6-dichlorophenyl)-2-phenylquinoline-4-carboxamide is O=C(Nc1c(Cl)cccc1Cl)c1cc(-c2ccccc2)nc2ccccc12.
What is the InChIKey of N-(2,6-dichlorophenyl)-2-phenylquinoline-4-carboxamide?
The InChIKey is NFZJTFJQWQYOMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H14Cl2N2O/c23-17-10-6-11-18(24)21(17)26-22(27)16-13-20(14-7-2-1-3-8-14)25-19-12-5-4-9-15(16)19/h1-13H,(H,26,27).
What are the key properties of N-(2,6-dichlorophenyl)-2-phenylquinoline-4-carboxamide?
N-(2,6-dichlorophenyl)-2-phenylquinoline-4-carboxamide has a molecular weight of 393.27 g/mol, XLogP of 6.46, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dichlorophenyl)-2-phenylquinoline-4-carboxamide is sourced from PubChem (CID 2259441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).