N-(2,6-dichlorophenyl)-2-(4-ethoxyphenyl)quinoline-4-carboxamide

C24H18Cl2N2O2 — CID 4278019

IUPACN-(2,6-dichlorophenyl)-2-(4-ethoxyphenyl)quinoline-4-carboxamide
SMILESCCOc1ccc(-c2cc(C(=O)Nc3c(Cl)cccc3Cl)c3ccccc3n2)cc1
InChIInChI=1S/C24H18Cl2N2O2/c1-2-30-16-12-10-15(11-13-16)22-14-18(17-6-3-4-9-21(17)27-22)24(29)28-23-19(25)7-5-8-20(23)26/h3-14H,2H2,1H3,(H,28,29)
InChIKeyNHCLBRMDSHQBSP-UHFFFAOYSA-N
MW437.33 g/mol
LogP6.86
Rot. Bonds5

About N-(2,6-dichlorophenyl)-2-(4-ethoxyphenyl)quinoline-4-carboxamide

N-(2,6-dichlorophenyl)-2-(4-ethoxyphenyl)quinoline-4-carboxamide (PubChem CID 4278019) has the molecular formula C24H18Cl2N2O2 and a molecular weight of 437.33 g/mol. Its IUPAC name is N-(2,6-dichlorophenyl)-2-(4-ethoxyphenyl)quinoline-4-carboxamide.

Molecular Properties

Compound NameN-(2,6-dichlorophenyl)-2-(4-ethoxyphenyl)quinoline-4-carboxamide
PubChem CID4278019
Molecular FormulaC24H18Cl2N2O2
Molecular Weight437.33 g/mol
Exact Mass436.07
IUPAC NameN-(2,6-dichlorophenyl)-2-(4-ethoxyphenyl)quinoline-4-carboxamide
SMILESCCOc1ccc(-c2cc(C(=O)Nc3c(Cl)cccc3Cl)c3ccccc3n2)cc1
InChIInChI=1S/C24H18Cl2N2O2/c1-2-30-16-12-10-15(11-13-16)22-14-18(17-6-3-4-9-21(17)27-22)24(29)28-23-19(25)7-5-8-20(23)26/h3-14H,2H2,1H3,(H,28,29)
InChIKeyNHCLBRMDSHQBSP-UHFFFAOYSA-N
XLogP6.86
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500437.33
LogP ≤ 56.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,6-diethylphenyl)-2-(4-ethoxyphenyl)quinoline-4-carboxamide
CID 3426683
N-(3-chloro-2-pyridinyl)-2-(4-ethoxyphenyl)quinoline-4-carboxamide
CID 2165739
N-(2,6-dichlorophenyl)-2-phenylquinoline-4-carboxamide
CID 2259441
2-(4-chlorophenyl)-N-(4-ethoxyphenyl)quinoline-4-carboxamide
CID 3128623
2-(4-ethoxyphenyl)-N-(3-methyl-2-pyridinyl)quinoline-4-carboxamide
CID 1358364
dimethyl 5-[[2-(4-ethoxyphenyl)quinoline-4-carbonyl]amino]benzene-1,3-dicarboxylate
CID 1291458
2-(3,4-dichlorophenyl)-N-(2-ethoxyphenyl)quinoline-4-carboxamide
CID 4611145
2-(4-ethoxyphenyl)-N-(4-naphthalen-1-yl-1,3-thiazol-2-yl)quinoline-4-carboxamide
CID 4649173
N-[1-(4-chlorophenyl)propan-2-yl]-2-(4-ethoxyphenyl)quinoline-4-carboxamide
CID 46098242
2-(4-ethoxyphenyl)-N-[2-(4-methoxyphenoxy)ethyl]quinoline-4-carboxamide
CID 46098671
N-[2,6-di(propan-2-yl)phenyl]-2-(4-methoxyphenyl)quinoline-4-carboxamide
CID 4863761
N-(6-bromo-1,3-benzothiazol-2-yl)-2-(4-ethoxyphenyl)quinoline-4-carboxamide
CID 4155578

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dichlorophenyl)-2-(4-ethoxyphenyl)quinoline-4-carboxamide?
The IUPAC name of N-(2,6-dichlorophenyl)-2-(4-ethoxyphenyl)quinoline-4-carboxamide (CID 4278019) is N-(2,6-dichlorophenyl)-2-(4-ethoxyphenyl)quinoline-4-carboxamide.
What is the SMILES notation for N-(2,6-dichlorophenyl)-2-(4-ethoxyphenyl)quinoline-4-carboxamide?
The canonical SMILES for N-(2,6-dichlorophenyl)-2-(4-ethoxyphenyl)quinoline-4-carboxamide is CCOc1ccc(-c2cc(C(=O)Nc3c(Cl)cccc3Cl)c3ccccc3n2)cc1.
What is the InChIKey of N-(2,6-dichlorophenyl)-2-(4-ethoxyphenyl)quinoline-4-carboxamide?
The InChIKey is NHCLBRMDSHQBSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18Cl2N2O2/c1-2-30-16-12-10-15(11-13-16)22-14-18(17-6-3-4-9-21(17)27-22)24(29)28-23-19(25)7-5-8-20(23)26/h3-14H,2H2,1H3,(H,28,29).
What are the key properties of N-(2,6-dichlorophenyl)-2-(4-ethoxyphenyl)quinoline-4-carboxamide?
N-(2,6-dichlorophenyl)-2-(4-ethoxyphenyl)quinoline-4-carboxamide has a molecular weight of 437.33 g/mol, XLogP of 6.86, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dichlorophenyl)-2-(4-ethoxyphenyl)quinoline-4-carboxamide is sourced from PubChem (CID 4278019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).