3-N-(3-chlorophenyl)-5-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide

C21H18ClN3O2 — CID 109108469

IUPAC3-N-(3-chlorophenyl)-5-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide
SMILESCCc1ccccc1NC(=O)c1cncc(C(=O)Nc2cccc(Cl)c2)c1
InChIInChI=1S/C21H18ClN3O2/c1-2-14-6-3-4-9-19(14)25-21(27)16-10-15(12-23-13-16)20(26)24-18-8-5-7-17(22)11-18/h3-13H,2H2,1H3,(H,24,26)(H,25,27)
InChIKeyGAMCVSCOTZCXBP-UHFFFAOYSA-N
MW379.85 g/mol
LogP4.80
Rot. Bonds5

About 3-N-(3-chlorophenyl)-5-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide

3-N-(3-chlorophenyl)-5-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide (PubChem CID 109108469) has the molecular formula C21H18ClN3O2 and a molecular weight of 379.85 g/mol. Its IUPAC name is 3-N-(3-chlorophenyl)-5-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide.

Molecular Properties

Compound Name3-N-(3-chlorophenyl)-5-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide
PubChem CID109108469
Molecular FormulaC21H18ClN3O2
Molecular Weight379.85 g/mol
Exact Mass379.11
IUPAC Name3-N-(3-chlorophenyl)-5-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide
SMILESCCc1ccccc1NC(=O)c1cncc(C(=O)Nc2cccc(Cl)c2)c1
InChIInChI=1S/C21H18ClN3O2/c1-2-14-6-3-4-9-19(14)25-21(27)16-10-15(12-23-13-16)20(26)24-18-8-5-7-17(22)11-18/h3-13H,2H2,1H3,(H,24,26)(H,25,27)
InChIKeyGAMCVSCOTZCXBP-UHFFFAOYSA-N
XLogP4.80
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.85
LogP ≤ 54.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-N-(3-cyanophenyl)-5-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide
CID 109108491
5-N-(3-chloro-2-methylphenyl)-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide
CID 109108471
5-N-(3-chlorophenyl)-3-N-(4-ethoxyphenyl)pyridine-3,5-dicarboxamide
CID 109108789
3-N-(4-ethoxyphenyl)-5-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide
CID 109108480
N-(3-acetylphenyl)-5-(2-ethylanilino)pyridine-3-carboxamide
CID 109243411
5-N-tert-butyl-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide
CID 109106923
5-[(4-chlorophenyl)methylamino]-N-(2-ethylphenyl)pyridine-3-carboxamide
CID 109234109
5-(2-ethylanilino)-N-(3-methylphenyl)pyridine-3-carboxamide
CID 109241836
N-(3-bromophenyl)-5-(2-ethylanilino)pyridine-3-carboxamide
CID 109243423
5-(3-chloroanilino)-N-(3-chlorophenyl)pyridine-3-carboxamide
CID 109244464
3-N-butyl-5-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide
CID 109102007
5-N-cyclopropyl-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide
CID 109101623

Frequently Asked Questions

What is the IUPAC name of 3-N-(3-chlorophenyl)-5-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide?
The IUPAC name of 3-N-(3-chlorophenyl)-5-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide (CID 109108469) is 3-N-(3-chlorophenyl)-5-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide.
What is the SMILES notation for 3-N-(3-chlorophenyl)-5-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide?
The canonical SMILES for 3-N-(3-chlorophenyl)-5-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide is CCc1ccccc1NC(=O)c1cncc(C(=O)Nc2cccc(Cl)c2)c1.
What is the InChIKey of 3-N-(3-chlorophenyl)-5-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide?
The InChIKey is GAMCVSCOTZCXBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18ClN3O2/c1-2-14-6-3-4-9-19(14)25-21(27)16-10-15(12-23-13-16)20(26)24-18-8-5-7-17(22)11-18/h3-13H,2H2,1H3,(H,24,26)(H,25,27).
What are the key properties of 3-N-(3-chlorophenyl)-5-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide?
3-N-(3-chlorophenyl)-5-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide has a molecular weight of 379.85 g/mol, XLogP of 4.80, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-(3-chlorophenyl)-5-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide is sourced from PubChem (CID 109108469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).