4-ethoxy-N-(2-methoxy-5-methylphenyl)-2-(3-methoxyphenyl)quinoline-6-carboxamide

C27H26N2O4 — CID 46318892

IUPAC4-ethoxy-N-(2-methoxy-5-methylphenyl)-2-(3-methoxyphenyl)quinoline-6-carboxamide
SMILESCCOc1cc(-c2cccc(OC)c2)nc2ccc(C(=O)Nc3cc(C)ccc3OC)cc12
InChIInChI=1S/C27H26N2O4/c1-5-33-26-16-23(18-7-6-8-20(14-18)31-3)28-22-11-10-19(15-21(22)26)27(30)29-24-13-17(2)9-12-25(24)32-4/h6-16H,5H2,1-4H3,(H,29,30)
InChIKeyUIOQCBFEWOWWDF-UHFFFAOYSA-N
MW442.52 g/mol
LogP5.88
Rot. Bonds7

About 4-ethoxy-N-(2-methoxy-5-methylphenyl)-2-(3-methoxyphenyl)quinoline-6-carboxamide

4-ethoxy-N-(2-methoxy-5-methylphenyl)-2-(3-methoxyphenyl)quinoline-6-carboxamide (PubChem CID 46318892) has the molecular formula C27H26N2O4 and a molecular weight of 442.52 g/mol. Its IUPAC name is 4-ethoxy-N-(2-methoxy-5-methylphenyl)-2-(3-methoxyphenyl)quinoline-6-carboxamide.

Molecular Properties

Compound Name4-ethoxy-N-(2-methoxy-5-methylphenyl)-2-(3-methoxyphenyl)quinoline-6-carboxamide
PubChem CID46318892
Molecular FormulaC27H26N2O4
Molecular Weight442.52 g/mol
Exact Mass442.19
IUPAC Name4-ethoxy-N-(2-methoxy-5-methylphenyl)-2-(3-methoxyphenyl)quinoline-6-carboxamide
SMILESCCOc1cc(-c2cccc(OC)c2)nc2ccc(C(=O)Nc3cc(C)ccc3OC)cc12
InChIInChI=1S/C27H26N2O4/c1-5-33-26-16-23(18-7-6-8-20(14-18)31-3)28-22-11-10-19(15-21(22)26)27(30)29-24-13-17(2)9-12-25(24)32-4/h6-16H,5H2,1-4H3,(H,29,30)
InChIKeyUIOQCBFEWOWWDF-UHFFFAOYSA-N
XLogP5.88
TPSA69.68 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500442.52
LogP ≤ 55.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,5-dimethoxyphenyl)-4-ethoxy-2-(3-methoxyphenyl)quinoline-6-carboxamide
CID 46318861
4-ethoxy-N-(2-ethylphenyl)-2-(3-methoxyphenyl)quinoline-6-carboxamide
CID 46318886
4-ethoxy-N,2-bis(3-methoxyphenyl)quinoline-6-carboxamide
CID 46318881
N-(2-carbamoylphenyl)-4-ethoxy-2-(3-methoxyphenyl)quinoline-6-carboxamide
CID 46318898
4-ethoxy-N-(4-methylphenyl)-2-phenylquinoline-6-carboxamide
CID 46318814
4-ethoxy-2-(4-methylphenyl)-N-(3,4,5-trimethoxyphenyl)quinoline-6-carboxamide
CID 46319060
4-ethoxy-N-(2-hydroxyphenyl)-2-(4-methylphenyl)quinoline-6-carboxamide
CID 46319059
ethyl 2-(3-methoxyphenyl)-4-[2-(3-methylanilino)-2-oxoethoxy]quinoline-6-carboxylate
CID 46298739
4-methoxy-N-[(3-methoxyphenyl)methyl]-2-(4-methylphenyl)quinoline-6-carboxamide
CID 46319113
1-(4-ethoxy-2-phenylquinolin-6-yl)-3-(3-methoxyphenyl)urea
CID 46385044
ethyl 4-[2-(4-chloroanilino)-2-oxoethoxy]-2-(3-methoxyphenyl)quinoline-6-carboxylate
CID 46298722
ethyl 4-ethoxy-2-phenylquinoline-6-carboxylate
CID 22425101

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N-(2-methoxy-5-methylphenyl)-2-(3-methoxyphenyl)quinoline-6-carboxamide?
The IUPAC name of 4-ethoxy-N-(2-methoxy-5-methylphenyl)-2-(3-methoxyphenyl)quinoline-6-carboxamide (CID 46318892) is 4-ethoxy-N-(2-methoxy-5-methylphenyl)-2-(3-methoxyphenyl)quinoline-6-carboxamide.
What is the SMILES notation for 4-ethoxy-N-(2-methoxy-5-methylphenyl)-2-(3-methoxyphenyl)quinoline-6-carboxamide?
The canonical SMILES for 4-ethoxy-N-(2-methoxy-5-methylphenyl)-2-(3-methoxyphenyl)quinoline-6-carboxamide is CCOc1cc(-c2cccc(OC)c2)nc2ccc(C(=O)Nc3cc(C)ccc3OC)cc12.
What is the InChIKey of 4-ethoxy-N-(2-methoxy-5-methylphenyl)-2-(3-methoxyphenyl)quinoline-6-carboxamide?
The InChIKey is UIOQCBFEWOWWDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H26N2O4/c1-5-33-26-16-23(18-7-6-8-20(14-18)31-3)28-22-11-10-19(15-21(22)26)27(30)29-24-13-17(2)9-12-25(24)32-4/h6-16H,5H2,1-4H3,(H,29,30).
What are the key properties of 4-ethoxy-N-(2-methoxy-5-methylphenyl)-2-(3-methoxyphenyl)quinoline-6-carboxamide?
4-ethoxy-N-(2-methoxy-5-methylphenyl)-2-(3-methoxyphenyl)quinoline-6-carboxamide has a molecular weight of 442.52 g/mol, XLogP of 5.88, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N-(2-methoxy-5-methylphenyl)-2-(3-methoxyphenyl)quinoline-6-carboxamide is sourced from PubChem (CID 46318892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).