4-ethoxy-N,2-bis(3-methoxyphenyl)quinoline-6-carboxamide

C26H24N2O4 — CID 46318881

IUPAC4-ethoxy-N,2-bis(3-methoxyphenyl)quinoline-6-carboxamide
SMILESCCOc1cc(-c2cccc(OC)c2)nc2ccc(C(=O)Nc3cccc(OC)c3)cc12
InChIInChI=1S/C26H24N2O4/c1-4-32-25-16-24(17-7-5-9-20(13-17)30-2)28-23-12-11-18(14-22(23)25)26(29)27-19-8-6-10-21(15-19)31-3/h5-16H,4H2,1-3H3,(H,27,29)
InChIKeyAYTHOFPOSHHPSQ-UHFFFAOYSA-N
MW428.49 g/mol
LogP5.57
Rot. Bonds7

About 4-ethoxy-N,2-bis(3-methoxyphenyl)quinoline-6-carboxamide

4-ethoxy-N,2-bis(3-methoxyphenyl)quinoline-6-carboxamide (PubChem CID 46318881) has the molecular formula C26H24N2O4 and a molecular weight of 428.49 g/mol. Its IUPAC name is 4-ethoxy-N,2-bis(3-methoxyphenyl)quinoline-6-carboxamide.

Molecular Properties

Compound Name4-ethoxy-N,2-bis(3-methoxyphenyl)quinoline-6-carboxamide
PubChem CID46318881
Molecular FormulaC26H24N2O4
Molecular Weight428.49 g/mol
Exact Mass428.17
IUPAC Name4-ethoxy-N,2-bis(3-methoxyphenyl)quinoline-6-carboxamide
SMILESCCOc1cc(-c2cccc(OC)c2)nc2ccc(C(=O)Nc3cccc(OC)c3)cc12
InChIInChI=1S/C26H24N2O4/c1-4-32-25-16-24(17-7-5-9-20(13-17)30-2)28-23-12-11-18(14-22(23)25)26(29)27-19-8-6-10-21(15-19)31-3/h5-16H,4H2,1-3H3,(H,27,29)
InChIKeyAYTHOFPOSHHPSQ-UHFFFAOYSA-N
XLogP5.57
TPSA69.68 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500428.49
LogP ≤ 55.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-ethoxy-N-(2-ethylphenyl)-2-(3-methoxyphenyl)quinoline-6-carboxamide
CID 46318886
N-(2,5-dimethoxyphenyl)-4-ethoxy-2-(3-methoxyphenyl)quinoline-6-carboxamide
CID 46318861
4-ethoxy-N-(2-methoxy-5-methylphenyl)-2-(3-methoxyphenyl)quinoline-6-carboxamide
CID 46318892
N-(2-carbamoylphenyl)-4-ethoxy-2-(3-methoxyphenyl)quinoline-6-carboxamide
CID 46318898
1-(4-ethoxy-2-phenylquinolin-6-yl)-3-(3-methoxyphenyl)urea
CID 46385044
ethyl 2-(3-methoxyphenyl)-4-[2-(3-methylanilino)-2-oxoethoxy]quinoline-6-carboxylate
CID 46298739
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
ethyl 4-[2-(3,4-difluoroanilino)-2-oxoethoxy]-2-(3-methoxyphenyl)quinoline-6-carboxylate
CID 46298723
ethyl 4-[2-(4-chloroanilino)-2-oxoethoxy]-2-(3-methoxyphenyl)quinoline-6-carboxylate
CID 46298722
ethyl 4-[2-(3-fluoro-4-methylanilino)-2-oxoethoxy]-2-(3-methoxyphenyl)quinoline-6-carboxylate
CID 46298724
4-ethoxy-3-fluoro-N-(3-methoxyphenyl)benzamide
CID 110762258

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N,2-bis(3-methoxyphenyl)quinoline-6-carboxamide?
The IUPAC name of 4-ethoxy-N,2-bis(3-methoxyphenyl)quinoline-6-carboxamide (CID 46318881) is 4-ethoxy-N,2-bis(3-methoxyphenyl)quinoline-6-carboxamide.
What is the SMILES notation for 4-ethoxy-N,2-bis(3-methoxyphenyl)quinoline-6-carboxamide?
The canonical SMILES for 4-ethoxy-N,2-bis(3-methoxyphenyl)quinoline-6-carboxamide is CCOc1cc(-c2cccc(OC)c2)nc2ccc(C(=O)Nc3cccc(OC)c3)cc12.
What is the InChIKey of 4-ethoxy-N,2-bis(3-methoxyphenyl)quinoline-6-carboxamide?
The InChIKey is AYTHOFPOSHHPSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24N2O4/c1-4-32-25-16-24(17-7-5-9-20(13-17)30-2)28-23-12-11-18(14-22(23)25)26(29)27-19-8-6-10-21(15-19)31-3/h5-16H,4H2,1-3H3,(H,27,29).
What are the key properties of 4-ethoxy-N,2-bis(3-methoxyphenyl)quinoline-6-carboxamide?
4-ethoxy-N,2-bis(3-methoxyphenyl)quinoline-6-carboxamide has a molecular weight of 428.49 g/mol, XLogP of 5.57, 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-bis(3-methoxyphenyl)quinoline-6-carboxamide is sourced from PubChem (CID 46318881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).