4-ethoxy-N-(4-methylphenyl)-2-phenylquinoline-6-carboxamide

C25H22N2O2 — CID 46318814

IUPAC4-ethoxy-N-(4-methylphenyl)-2-phenylquinoline-6-carboxamide
SMILESCCOc1cc(-c2ccccc2)nc2ccc(C(=O)Nc3ccc(C)cc3)cc12
InChIInChI=1S/C25H22N2O2/c1-3-29-24-16-23(18-7-5-4-6-8-18)27-22-14-11-19(15-21(22)24)25(28)26-20-12-9-17(2)10-13-20/h4-16H,3H2,1-2H3,(H,26,28)
InChIKeyXMOYXJZZKUOCJO-UHFFFAOYSA-N
MW382.46 g/mol
LogP5.86
Rot. Bonds5

About 4-ethoxy-N-(4-methylphenyl)-2-phenylquinoline-6-carboxamide

4-ethoxy-N-(4-methylphenyl)-2-phenylquinoline-6-carboxamide (PubChem CID 46318814) has the molecular formula C25H22N2O2 and a molecular weight of 382.46 g/mol. Its IUPAC name is 4-ethoxy-N-(4-methylphenyl)-2-phenylquinoline-6-carboxamide.

Molecular Properties

Compound Name4-ethoxy-N-(4-methylphenyl)-2-phenylquinoline-6-carboxamide
PubChem CID46318814
Molecular FormulaC25H22N2O2
Molecular Weight382.46 g/mol
Exact Mass382.17
IUPAC Name4-ethoxy-N-(4-methylphenyl)-2-phenylquinoline-6-carboxamide
SMILESCCOc1cc(-c2ccccc2)nc2ccc(C(=O)Nc3ccc(C)cc3)cc12
InChIInChI=1S/C25H22N2O2/c1-3-29-24-16-23(18-7-5-4-6-8-18)27-22-14-11-19(15-21(22)24)25(28)26-20-12-9-17(2)10-13-20/h4-16H,3H2,1-2H3,(H,26,28)
InChIKeyXMOYXJZZKUOCJO-UHFFFAOYSA-N
XLogP5.86
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500382.46
LogP ≤ 55.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-ethoxy-N-(2-hydroxyphenyl)-2-(4-methylphenyl)quinoline-6-carboxamide
CID 46319059
4-ethoxy-2-(4-methylphenyl)-N-(3,4,5-trimethoxyphenyl)quinoline-6-carboxamide
CID 46319060
N-(4-ethoxy-2-phenylquinolin-6-yl)-1,3-benzodioxole-5-carboxamide
CID 53113418
ethyl 4-ethoxy-2-phenylquinoline-6-carboxylate
CID 22425101
4-ethoxy-2-(4-fluorophenyl)-N-(2-hydroxyphenyl)quinoline-6-carboxamide
CID 46319037
4-ethoxy-N-[(2R)-2-hydroxypropyl]-2-(4-methylphenyl)quinoline-6-carboxamide
CID 92867755
4-ethoxy-N,2-bis(3-methoxyphenyl)quinoline-6-carboxamide
CID 46318881
4-ethoxy-N-(2-methoxy-5-methylphenyl)-2-(3-methoxyphenyl)quinoline-6-carboxamide
CID 46318892
N-[4-methoxy-2-(4-methylphenyl)quinolin-6-yl]benzamide
CID 53001311
4-ethoxy-N-(2-ethylphenyl)-2-(3-methoxyphenyl)quinoline-6-carboxamide
CID 46318886
N-(2-ethoxyphenyl)-2-(6-methyl-2-phenylquinolin-4-yl)oxyacetamide
CID 46298833
methyl 2-[6-[(4-chlorobenzoyl)amino]-2-(4-methylphenyl)quinolin-4-yl]oxyacetate
CID 53113515

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N-(4-methylphenyl)-2-phenylquinoline-6-carboxamide?
The IUPAC name of 4-ethoxy-N-(4-methylphenyl)-2-phenylquinoline-6-carboxamide (CID 46318814) is 4-ethoxy-N-(4-methylphenyl)-2-phenylquinoline-6-carboxamide.
What is the SMILES notation for 4-ethoxy-N-(4-methylphenyl)-2-phenylquinoline-6-carboxamide?
The canonical SMILES for 4-ethoxy-N-(4-methylphenyl)-2-phenylquinoline-6-carboxamide is CCOc1cc(-c2ccccc2)nc2ccc(C(=O)Nc3ccc(C)cc3)cc12.
What is the InChIKey of 4-ethoxy-N-(4-methylphenyl)-2-phenylquinoline-6-carboxamide?
The InChIKey is XMOYXJZZKUOCJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H22N2O2/c1-3-29-24-16-23(18-7-5-4-6-8-18)27-22-14-11-19(15-21(22)24)25(28)26-20-12-9-17(2)10-13-20/h4-16H,3H2,1-2H3,(H,26,28).
What are the key properties of 4-ethoxy-N-(4-methylphenyl)-2-phenylquinoline-6-carboxamide?
4-ethoxy-N-(4-methylphenyl)-2-phenylquinoline-6-carboxamide has a molecular weight of 382.46 g/mol, XLogP of 5.86, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N-(4-methylphenyl)-2-phenylquinoline-6-carboxamide is sourced from PubChem (CID 46318814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).