5-N-(3-chloro-2-methylphenyl)-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide

C22H20ClN3O2 — CID 109108471

IUPAC5-N-(3-chloro-2-methylphenyl)-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide
SMILESCCc1ccccc1NC(=O)c1cncc(C(=O)Nc2cccc(Cl)c2C)c1
InChIInChI=1S/C22H20ClN3O2/c1-3-15-7-4-5-9-20(15)26-22(28)17-11-16(12-24-13-17)21(27)25-19-10-6-8-18(23)14(19)2/h4-13H,3H2,1-2H3,(H,25,27)(H,26,28)
InChIKeyNRNVZZDJNLKILO-UHFFFAOYSA-N
MW393.87 g/mol
LogP5.11
Rot. Bonds5

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

5-N-(3-chloro-2-methylphenyl)-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide (PubChem CID 109108471) has the molecular formula C22H20ClN3O2 and a molecular weight of 393.87 g/mol. Its IUPAC name is 5-N-(3-chloro-2-methylphenyl)-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide.

Molecular Properties

Compound Name5-N-(3-chloro-2-methylphenyl)-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide
PubChem CID109108471
Molecular FormulaC22H20ClN3O2
Molecular Weight393.87 g/mol
Exact Mass393.12
IUPAC Name5-N-(3-chloro-2-methylphenyl)-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide
SMILESCCc1ccccc1NC(=O)c1cncc(C(=O)Nc2cccc(Cl)c2C)c1
InChIInChI=1S/C22H20ClN3O2/c1-3-15-7-4-5-9-20(15)26-22(28)17-11-16(12-24-13-17)21(27)25-19-10-6-8-18(23)14(19)2/h4-13H,3H2,1-2H3,(H,25,27)(H,26,28)
InChIKeyNRNVZZDJNLKILO-UHFFFAOYSA-N
XLogP5.11
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500393.87
LogP ≤ 55.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-N-butyl-5-N-(3-chloro-2-methylphenyl)pyridine-3,5-dicarboxamide
CID 109102023
3-N-(3-chlorophenyl)-5-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide
CID 109108469
N-(3-chloro-2-methylphenyl)-2-(2-ethylanilino)pyrimidine-5-carboxamide
CID 109267368
N-(2-ethylphenyl)-5-(piperidine-1-carbonyl)pyridine-3-carboxamide
CID 109102918
5-N-tert-butyl-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide
CID 109106923
N-(3-chloro-2-methylphenyl)-5-(4-methylpiperazine-1-carbonyl)pyridine-3-carboxamide
CID 109104479
N-(3-chloro-2-methylphenyl)-5-(2-methylpropylamino)pyridine-3-carboxamide
CID 109225036
5-N-cyclopropyl-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide
CID 109101623
3-N-butyl-5-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide
CID 109102007
N-(3-chloro-2-methylphenyl)pyridine-3-carboxamide;hydrochloride
CID 110756419
3-N-(3-cyanophenyl)-5-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide
CID 109108491
N-(3-chloro-2-methylphenyl)-4-ethylbenzamide
CID 2671399

Frequently Asked Questions

What is the IUPAC name of 5-N-(3-chloro-2-methylphenyl)-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide?
The IUPAC name of 5-N-(3-chloro-2-methylphenyl)-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide (CID 109108471) is 5-N-(3-chloro-2-methylphenyl)-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide.
What is the SMILES notation for 5-N-(3-chloro-2-methylphenyl)-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide?
The canonical SMILES for 5-N-(3-chloro-2-methylphenyl)-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide is CCc1ccccc1NC(=O)c1cncc(C(=O)Nc2cccc(Cl)c2C)c1.
What is the InChIKey of 5-N-(3-chloro-2-methylphenyl)-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide?
The InChIKey is NRNVZZDJNLKILO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20ClN3O2/c1-3-15-7-4-5-9-20(15)26-22(28)17-11-16(12-24-13-17)21(27)25-19-10-6-8-18(23)14(19)2/h4-13H,3H2,1-2H3,(H,25,27)(H,26,28).
What are the key properties of 5-N-(3-chloro-2-methylphenyl)-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide?
5-N-(3-chloro-2-methylphenyl)-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide has a molecular weight of 393.87 g/mol, XLogP of 5.11, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-(3-chloro-2-methylphenyl)-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide is sourced from PubChem (CID 109108471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).