5-(N-ethylanilino)-N-quinolin-8-ylpyridine-3-carboxamide

C23H20N4O — CID 109243659

IUPAC5-(N-ethylanilino)-N-quinolin-8-ylpyridine-3-carboxamide
SMILESCCN(c1ccccc1)c1cncc(C(=O)Nc2cccc3cccnc23)c1
InChIInChI=1S/C23H20N4O/c1-2-27(19-10-4-3-5-11-19)20-14-18(15-24-16-20)23(28)26-21-12-6-8-17-9-7-13-25-22(17)21/h3-16H,2H2,1H3,(H,26,28)
InChIKeyMDEALFOKSXODCO-UHFFFAOYSA-N
MW368.44 g/mol
LogP5.04
Rot. Bonds5

About 5-(N-ethylanilino)-N-quinolin-8-ylpyridine-3-carboxamide

5-(N-ethylanilino)-N-quinolin-8-ylpyridine-3-carboxamide (PubChem CID 109243659) has the molecular formula C23H20N4O and a molecular weight of 368.44 g/mol. Its IUPAC name is 5-(N-ethylanilino)-N-quinolin-8-ylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-(N-ethylanilino)-N-quinolin-8-ylpyridine-3-carboxamide
PubChem CID109243659
Molecular FormulaC23H20N4O
Molecular Weight368.44 g/mol
Exact Mass368.16
IUPAC Name5-(N-ethylanilino)-N-quinolin-8-ylpyridine-3-carboxamide
SMILESCCN(c1ccccc1)c1cncc(C(=O)Nc2cccc3cccnc23)c1
InChIInChI=1S/C23H20N4O/c1-2-27(19-10-4-3-5-11-19)20-14-18(15-24-16-20)23(28)26-21-12-6-8-17-9-7-13-25-22(17)21/h3-16H,2H2,1H3,(H,26,28)
InChIKeyMDEALFOKSXODCO-UHFFFAOYSA-N
XLogP5.04
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500368.44
LogP ≤ 55.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(N-ethylanilino)-N-(2-methylphenyl)pyridine-3-carboxamide
CID 109241654
5-bromo-N-quinolin-8-ylpyridine-3-carboxamide
CID 837055
3-N-(2-methoxyphenyl)-5-N-quinolin-8-ylpyridine-3,5-dicarboxamide
CID 109108883
5-N-(1-phenylethyl)-3-N-quinolin-8-ylpyridine-3,5-dicarboxamide
CID 109105406
N-(3-acetamidophenyl)-5-(N-ethylanilino)pyridine-3-carboxamide
CID 109243646
N-(2-ethylphenyl)-5-(quinolin-8-ylamino)pyridine-3-carboxamide
CID 109243373
3-N-methyl-3-N-phenyl-1-N-quinolin-8-ylbenzene-1,3-dicarboxamide
CID 109057063
3-N-(3,4-dimethylphenyl)-5-N-quinolin-8-ylpyridine-3,5-dicarboxamide
CID 109108326
5-(N-ethylanilino)-N-(2-ethyl-6-methylphenyl)pyridine-3-carboxamide
CID 109243612
5-(2-tert-butylanilino)-N-quinolin-8-ylpyridine-3-carboxamide
CID 109244039
N-(2,5-dimethoxyphenyl)-5-(N-ethylanilino)pyridine-3-carboxamide
CID 109243638
5-(4-ethylpiperazine-1-carbonyl)-N-quinolin-8-ylpyridine-3-carboxamide
CID 109104633

Frequently Asked Questions

What is the IUPAC name of 5-(N-ethylanilino)-N-quinolin-8-ylpyridine-3-carboxamide?
The IUPAC name of 5-(N-ethylanilino)-N-quinolin-8-ylpyridine-3-carboxamide (CID 109243659) is 5-(N-ethylanilino)-N-quinolin-8-ylpyridine-3-carboxamide.
What is the SMILES notation for 5-(N-ethylanilino)-N-quinolin-8-ylpyridine-3-carboxamide?
The canonical SMILES for 5-(N-ethylanilino)-N-quinolin-8-ylpyridine-3-carboxamide is CCN(c1ccccc1)c1cncc(C(=O)Nc2cccc3cccnc23)c1.
What is the InChIKey of 5-(N-ethylanilino)-N-quinolin-8-ylpyridine-3-carboxamide?
The InChIKey is MDEALFOKSXODCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N4O/c1-2-27(19-10-4-3-5-11-19)20-14-18(15-24-16-20)23(28)26-21-12-6-8-17-9-7-13-25-22(17)21/h3-16H,2H2,1H3,(H,26,28).
What are the key properties of 5-(N-ethylanilino)-N-quinolin-8-ylpyridine-3-carboxamide?
5-(N-ethylanilino)-N-quinolin-8-ylpyridine-3-carboxamide has a molecular weight of 368.44 g/mol, XLogP of 5.04, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(N-ethylanilino)-N-quinolin-8-ylpyridine-3-carboxamide is sourced from PubChem (CID 109243659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).