N-(4-ethoxyphenyl)-6-ethyl-2-phenylquinoline-4-carboxamide

C26H24N2O2 — CID 3898421

IUPACN-(4-ethoxyphenyl)-6-ethyl-2-phenylquinoline-4-carboxamide
SMILESCCOc1ccc(NC(=O)c2cc(-c3ccccc3)nc3ccc(CC)cc23)cc1
InChIInChI=1S/C26H24N2O2/c1-3-18-10-15-24-22(16-18)23(17-25(28-24)19-8-6-5-7-9-19)26(29)27-20-11-13-21(14-12-20)30-4-2/h5-17H,3-4H2,1-2H3,(H,27,29)
InChIKeyUQNGNQPHQVPHHZ-UHFFFAOYSA-N
MW396.49 g/mol
LogP6.12
Rot. Bonds6

About N-(4-ethoxyphenyl)-6-ethyl-2-phenylquinoline-4-carboxamide

N-(4-ethoxyphenyl)-6-ethyl-2-phenylquinoline-4-carboxamide (PubChem CID 3898421) has the molecular formula C26H24N2O2 and a molecular weight of 396.49 g/mol. Its IUPAC name is N-(4-ethoxyphenyl)-6-ethyl-2-phenylquinoline-4-carboxamide.

Molecular Properties

Compound NameN-(4-ethoxyphenyl)-6-ethyl-2-phenylquinoline-4-carboxamide
PubChem CID3898421
Molecular FormulaC26H24N2O2
Molecular Weight396.49 g/mol
Exact Mass396.18
IUPAC NameN-(4-ethoxyphenyl)-6-ethyl-2-phenylquinoline-4-carboxamide
SMILESCCOc1ccc(NC(=O)c2cc(-c3ccccc3)nc3ccc(CC)cc23)cc1
InChIInChI=1S/C26H24N2O2/c1-3-18-10-15-24-22(16-18)23(17-25(28-24)19-8-6-5-7-9-19)26(29)27-20-11-13-21(14-12-20)30-4-2/h5-17H,3-4H2,1-2H3,(H,27,29)
InChIKeyUQNGNQPHQVPHHZ-UHFFFAOYSA-N
XLogP6.12
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500396.49
LogP ≤ 56.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-ethoxyphenyl)-6-ethylquinoline-4-carboxylic acid
CID 4021744
2-(4-chlorophenyl)-N-(4-ethoxyphenyl)quinoline-4-carboxamide
CID 3128623
dimethyl 5-[[2-(4-ethoxyphenyl)quinoline-4-carbonyl]amino]benzene-1,3-dicarboxylate
CID 1291458
6-ethyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylic acid
CID 4711645
N-(4-methoxyphenyl)-2-phenylquinoline-4-carboxamide
CID 1035332
N-(2,6-diethylphenyl)-2-(4-ethoxyphenyl)quinoline-4-carboxamide
CID 3426683
6-ethoxy-2-(4-ethoxyphenyl)quinoline-4-carboxylic acid
CID 3511446
N-(2,6-dichlorophenyl)-2-(4-ethoxyphenyl)quinoline-4-carboxamide
CID 4278019
N-(4-phenylmethoxyphenyl)-2-pyridin-4-ylquinoline-4-carboxamide
CID 1261334
2-(3,4-dichlorophenyl)-N-(4-ethylphenyl)quinoline-4-carboxamide
CID 3285016
7-methoxy-N-(4-methylphenyl)-2-phenylquinoline-4-carboxamide
CID 164616063
4-ethoxy-N-(4-methylphenyl)-2-phenylquinoline-6-carboxamide
CID 46318814

Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxyphenyl)-6-ethyl-2-phenylquinoline-4-carboxamide?
The IUPAC name of N-(4-ethoxyphenyl)-6-ethyl-2-phenylquinoline-4-carboxamide (CID 3898421) is N-(4-ethoxyphenyl)-6-ethyl-2-phenylquinoline-4-carboxamide.
What is the SMILES notation for N-(4-ethoxyphenyl)-6-ethyl-2-phenylquinoline-4-carboxamide?
The canonical SMILES for N-(4-ethoxyphenyl)-6-ethyl-2-phenylquinoline-4-carboxamide is CCOc1ccc(NC(=O)c2cc(-c3ccccc3)nc3ccc(CC)cc23)cc1.
What is the InChIKey of N-(4-ethoxyphenyl)-6-ethyl-2-phenylquinoline-4-carboxamide?
The InChIKey is UQNGNQPHQVPHHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24N2O2/c1-3-18-10-15-24-22(16-18)23(17-25(28-24)19-8-6-5-7-9-19)26(29)27-20-11-13-21(14-12-20)30-4-2/h5-17H,3-4H2,1-2H3,(H,27,29).
What are the key properties of N-(4-ethoxyphenyl)-6-ethyl-2-phenylquinoline-4-carboxamide?
N-(4-ethoxyphenyl)-6-ethyl-2-phenylquinoline-4-carboxamide has a molecular weight of 396.49 g/mol, XLogP of 6.12, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxyphenyl)-6-ethyl-2-phenylquinoline-4-carboxamide is sourced from PubChem (CID 3898421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).