2-(4-bromophenyl)-N-(2-ethylphenyl)quinoline-4-carboxamide

C24H19BrN2O — CID 4289589

IUPAC2-(4-bromophenyl)-N-(2-ethylphenyl)quinoline-4-carboxamide
SMILESCCc1ccccc1NC(=O)c1cc(-c2ccc(Br)cc2)nc2ccccc12
InChIInChI=1S/C24H19BrN2O/c1-2-16-7-3-5-9-21(16)27-24(28)20-15-23(17-11-13-18(25)14-12-17)26-22-10-6-4-8-19(20)22/h3-15H,2H2,1H3,(H,27,28)
InChIKeyQGVWBACGCJYAHS-UHFFFAOYSA-N
MW431.33 g/mol
LogP6.48
Rot. Bonds4

About 2-(4-bromophenyl)-N-(2-ethylphenyl)quinoline-4-carboxamide

2-(4-bromophenyl)-N-(2-ethylphenyl)quinoline-4-carboxamide (PubChem CID 4289589) has the molecular formula C24H19BrN2O and a molecular weight of 431.33 g/mol. Its IUPAC name is 2-(4-bromophenyl)-N-(2-ethylphenyl)quinoline-4-carboxamide.

Molecular Properties

Compound Name2-(4-bromophenyl)-N-(2-ethylphenyl)quinoline-4-carboxamide
PubChem CID4289589
Molecular FormulaC24H19BrN2O
Molecular Weight431.33 g/mol
Exact Mass430.07
IUPAC Name2-(4-bromophenyl)-N-(2-ethylphenyl)quinoline-4-carboxamide
SMILESCCc1ccccc1NC(=O)c1cc(-c2ccc(Br)cc2)nc2ccccc12
InChIInChI=1S/C24H19BrN2O/c1-2-16-7-3-5-9-21(16)27-24(28)20-15-23(17-11-13-18(25)14-12-17)26-22-10-6-4-8-19(20)22/h3-15H,2H2,1H3,(H,27,28)
InChIKeyQGVWBACGCJYAHS-UHFFFAOYSA-N
XLogP6.48
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500431.33
LogP ≤ 56.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-bromophenyl)-N-(3,5-dimethylphenyl)quinoline-4-carboxamide
CID 2163425
2-(2,4-dimethylphenyl)-N-(2-ethylphenyl)quinoline-4-carboxamide
CID 3129381
2-(5-chlorothiophen-2-yl)-N-(2-ethylphenyl)quinoline-4-carboxamide
CID 3457981
2-(4-bromophenyl)-N-(2-methylpropyl)quinoline-4-carboxamide
CID 5116892
2-(4-bromophenyl)-N-(5-methyl-1,2-oxazol-3-yl)quinoline-4-carboxamide
CID 1358287
N-(2,3-dimethylphenyl)-2-(4-ethylphenyl)quinoline-4-carboxamide
CID 5141329
N-(2,4-dibromophenyl)-2-(4-methoxyphenyl)quinoline-4-carboxamide
CID 4056955
N-(2-methylphenyl)-2-phenylquinoline-4-carboxamide
CID 769490
methyl 2-(4-bromophenyl)quinoline-4-carboxylate
CID 874713
N-(2,6-diethylphenyl)-2-(4-ethoxyphenyl)quinoline-4-carboxamide
CID 3426683
N-(2-bromophenyl)-2-(3-methylphenyl)quinoline-4-carboxamide
CID 4159405
N-(4-bromo-2-fluorophenyl)-2-(3,4-dimethylphenyl)quinoline-4-carboxamide
CID 4685628

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenyl)-N-(2-ethylphenyl)quinoline-4-carboxamide?
The IUPAC name of 2-(4-bromophenyl)-N-(2-ethylphenyl)quinoline-4-carboxamide (CID 4289589) is 2-(4-bromophenyl)-N-(2-ethylphenyl)quinoline-4-carboxamide.
What is the SMILES notation for 2-(4-bromophenyl)-N-(2-ethylphenyl)quinoline-4-carboxamide?
The canonical SMILES for 2-(4-bromophenyl)-N-(2-ethylphenyl)quinoline-4-carboxamide is CCc1ccccc1NC(=O)c1cc(-c2ccc(Br)cc2)nc2ccccc12.
What is the InChIKey of 2-(4-bromophenyl)-N-(2-ethylphenyl)quinoline-4-carboxamide?
The InChIKey is QGVWBACGCJYAHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19BrN2O/c1-2-16-7-3-5-9-21(16)27-24(28)20-15-23(17-11-13-18(25)14-12-17)26-22-10-6-4-8-19(20)22/h3-15H,2H2,1H3,(H,27,28).
What are the key properties of 2-(4-bromophenyl)-N-(2-ethylphenyl)quinoline-4-carboxamide?
2-(4-bromophenyl)-N-(2-ethylphenyl)quinoline-4-carboxamide has a molecular weight of 431.33 g/mol, XLogP of 6.48, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenyl)-N-(2-ethylphenyl)quinoline-4-carboxamide is sourced from PubChem (CID 4289589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).