5-N-(4-ethylphenyl)-3-N-(4-methylphenyl)pyridine-3,5-dicarboxamide

C22H21N3O2 — CID 109107992

IUPAC5-N-(4-ethylphenyl)-3-N-(4-methylphenyl)pyridine-3,5-dicarboxamide
SMILESCCc1ccc(NC(=O)c2cncc(C(=O)Nc3ccc(C)cc3)c2)cc1
InChIInChI=1S/C22H21N3O2/c1-3-16-6-10-20(11-7-16)25-22(27)18-12-17(13-23-14-18)21(26)24-19-8-4-15(2)5-9-19/h4-14H,3H2,1-2H3,(H,24,26)(H,25,27)
InChIKeyVDCNSZWHQNGFOB-UHFFFAOYSA-N
MW359.43 g/mol
LogP4.46
Rot. Bonds5

About 5-N-(4-ethylphenyl)-3-N-(4-methylphenyl)pyridine-3,5-dicarboxamide

5-N-(4-ethylphenyl)-3-N-(4-methylphenyl)pyridine-3,5-dicarboxamide (PubChem CID 109107992) has the molecular formula C22H21N3O2 and a molecular weight of 359.43 g/mol. Its IUPAC name is 5-N-(4-ethylphenyl)-3-N-(4-methylphenyl)pyridine-3,5-dicarboxamide.

Molecular Properties

Compound Name5-N-(4-ethylphenyl)-3-N-(4-methylphenyl)pyridine-3,5-dicarboxamide
PubChem CID109107992
Molecular FormulaC22H21N3O2
Molecular Weight359.43 g/mol
Exact Mass359.16
IUPAC Name5-N-(4-ethylphenyl)-3-N-(4-methylphenyl)pyridine-3,5-dicarboxamide
SMILESCCc1ccc(NC(=O)c2cncc(C(=O)Nc3ccc(C)cc3)c2)cc1
InChIInChI=1S/C22H21N3O2/c1-3-16-6-10-20(11-7-16)25-22(27)18-12-17(13-23-14-18)21(26)24-19-8-4-15(2)5-9-19/h4-14H,3H2,1-2H3,(H,24,26)(H,25,27)
InChIKeyVDCNSZWHQNGFOB-UHFFFAOYSA-N
XLogP4.46
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.43
LogP ≤ 54.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(4-ethylanilino)-N-(4-methylphenyl)pyridine-3-carboxamide
CID 109242019
N-(4-ethylphenyl)-5-hydroxypyridine-3-carboxamide
CID 55258455
5-methyl-N-(4-methylphenyl)pyridine-3-carboxamide
CID 143173797
ethane;4-ethyl-N-(4-methylphenyl)benzamide
CID 143234775
5-N-butan-2-yl-3-N-(4-ethylphenyl)pyridine-3,5-dicarboxamide
CID 109102383
3-N-[2-(dimethylamino)ethyl]-5-N-(4-ethylphenyl)pyridine-3,5-dicarboxamide
CID 109104100
5-N-tert-butyl-3-N-(4-methylphenyl)pyridine-3,5-dicarboxamide
CID 109106913
5-(4-acetylanilino)-N-(4-ethylphenyl)pyridine-3-carboxamide
CID 109243465
5-(4-ethylanilino)-N-(3-methylphenyl)pyridine-3-carboxamide
CID 109241837
3-N-(4-ethylphenyl)-5-N-(1-phenylethyl)pyridine-3,5-dicarboxamide
CID 109105379
5-N-(2,4-dimethylphenyl)-3-N-(4-methylphenyl)pyridine-3,5-dicarboxamide
CID 109107985
5-(butan-2-ylamino)-N-(4-methylphenyl)pyridine-3-carboxamide
CID 109225394

Frequently Asked Questions

What is the IUPAC name of 5-N-(4-ethylphenyl)-3-N-(4-methylphenyl)pyridine-3,5-dicarboxamide?
The IUPAC name of 5-N-(4-ethylphenyl)-3-N-(4-methylphenyl)pyridine-3,5-dicarboxamide (CID 109107992) is 5-N-(4-ethylphenyl)-3-N-(4-methylphenyl)pyridine-3,5-dicarboxamide.
What is the SMILES notation for 5-N-(4-ethylphenyl)-3-N-(4-methylphenyl)pyridine-3,5-dicarboxamide?
The canonical SMILES for 5-N-(4-ethylphenyl)-3-N-(4-methylphenyl)pyridine-3,5-dicarboxamide is CCc1ccc(NC(=O)c2cncc(C(=O)Nc3ccc(C)cc3)c2)cc1.
What is the InChIKey of 5-N-(4-ethylphenyl)-3-N-(4-methylphenyl)pyridine-3,5-dicarboxamide?
The InChIKey is VDCNSZWHQNGFOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O2/c1-3-16-6-10-20(11-7-16)25-22(27)18-12-17(13-23-14-18)21(26)24-19-8-4-15(2)5-9-19/h4-14H,3H2,1-2H3,(H,24,26)(H,25,27).
What are the key properties of 5-N-(4-ethylphenyl)-3-N-(4-methylphenyl)pyridine-3,5-dicarboxamide?
5-N-(4-ethylphenyl)-3-N-(4-methylphenyl)pyridine-3,5-dicarboxamide has a molecular weight of 359.43 g/mol, XLogP of 4.46, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-(4-ethylphenyl)-3-N-(4-methylphenyl)pyridine-3,5-dicarboxamide is sourced from PubChem (CID 109107992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).