6-N-(4-chloro-2-methylphenyl)-2-N-[(3-methylphenyl)methyl]pyridine-2,6-dicarboxamide

C22H20ClN3O2 — CID 109097465

IUPAC6-N-(4-chloro-2-methylphenyl)-2-N-[(3-methylphenyl)methyl]pyridine-2,6-dicarboxamide
SMILESCc1cccc(CNC(=O)c2cccc(C(=O)Nc3ccc(Cl)cc3C)n2)c1
InChIInChI=1S/C22H20ClN3O2/c1-14-5-3-6-16(11-14)13-24-21(27)19-7-4-8-20(25-19)22(28)26-18-10-9-17(23)12-15(18)2/h3-12H,13H2,1-2H3,(H,24,27)(H,26,28)
InChIKeyUQNAVSGGRUNLFB-UHFFFAOYSA-N
MW393.87 g/mol
LogP4.53
Rot. Bonds5

About 6-N-(4-chloro-2-methylphenyl)-2-N-[(3-methylphenyl)methyl]pyridine-2,6-dicarboxamide

6-N-(4-chloro-2-methylphenyl)-2-N-[(3-methylphenyl)methyl]pyridine-2,6-dicarboxamide (PubChem CID 109097465) has the molecular formula C22H20ClN3O2 and a molecular weight of 393.87 g/mol. Its IUPAC name is 6-N-(4-chloro-2-methylphenyl)-2-N-[(3-methylphenyl)methyl]pyridine-2,6-dicarboxamide.

Molecular Properties

Compound Name6-N-(4-chloro-2-methylphenyl)-2-N-[(3-methylphenyl)methyl]pyridine-2,6-dicarboxamide
PubChem CID109097465
Molecular FormulaC22H20ClN3O2
Molecular Weight393.87 g/mol
Exact Mass393.12
IUPAC Name6-N-(4-chloro-2-methylphenyl)-2-N-[(3-methylphenyl)methyl]pyridine-2,6-dicarboxamide
SMILESCc1cccc(CNC(=O)c2cccc(C(=O)Nc3ccc(Cl)cc3C)n2)c1
InChIInChI=1S/C22H20ClN3O2/c1-14-5-3-6-16(11-14)13-24-21(27)19-7-4-8-20(25-19)22(28)26-18-10-9-17(23)12-15(18)2/h3-12H,13H2,1-2H3,(H,24,27)(H,26,28)
InChIKeyUQNAVSGGRUNLFB-UHFFFAOYSA-N
XLogP4.53
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.87
LogP ≤ 54.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-N-(2,4-difluorophenyl)-2-N-[(3-methylphenyl)methyl]pyridine-2,6-dicarboxamide
CID 109097480
6-N-[(3-methylphenyl)methyl]-2-N-[(4-methylphenyl)methyl]pyridine-2,6-dicarboxamide
CID 109097409
6-N-(4-chloro-2-methylphenyl)-2-N-(3-methylbutyl)pyridine-2,6-dicarboxamide
CID 109099370
6-N-(2-ethoxyphenyl)-2-N-[(3-methylphenyl)methyl]pyridine-2,6-dicarboxamide
CID 109097471
6-N,6-N-diethyl-2-N-[(3-methylphenyl)methyl]pyridine-2,6-dicarboxamide
CID 109097429
N-[(3-chlorophenyl)methyl]-2-(2,4-dimethylanilino)-1,3-thiazole-4-carboxamide
CID 50830719
2-N-[(3-methylphenyl)methyl]-6-N,6-N-dipropylpyridine-2,6-dicarboxamide
CID 109097438
5-N-(2,4-dimethylphenyl)-3-N-[(3-methylphenyl)methyl]pyridine-3,5-dicarboxamide
CID 109105208
2-[(4-chlorophenyl)methylamino]-N-[(3-methylphenyl)methyl]pyrimidine-4-carboxamide
CID 109304314
4-N-benzyl-2-N-(4-chloro-2-methylphenyl)pyridine-2,4-dicarboxamide
CID 109085349
6-N-(4-chloro-2-methylphenyl)-2-N-(4-methoxyphenyl)pyridine-2,6-dicarboxamide
CID 109100888
3-N-benzyl-5-N-(4-chloro-2-methylphenyl)pyridine-3,5-dicarboxamide
CID 109105042

Frequently Asked Questions

What is the IUPAC name of 6-N-(4-chloro-2-methylphenyl)-2-N-[(3-methylphenyl)methyl]pyridine-2,6-dicarboxamide?
The IUPAC name of 6-N-(4-chloro-2-methylphenyl)-2-N-[(3-methylphenyl)methyl]pyridine-2,6-dicarboxamide (CID 109097465) is 6-N-(4-chloro-2-methylphenyl)-2-N-[(3-methylphenyl)methyl]pyridine-2,6-dicarboxamide.
What is the SMILES notation for 6-N-(4-chloro-2-methylphenyl)-2-N-[(3-methylphenyl)methyl]pyridine-2,6-dicarboxamide?
The canonical SMILES for 6-N-(4-chloro-2-methylphenyl)-2-N-[(3-methylphenyl)methyl]pyridine-2,6-dicarboxamide is Cc1cccc(CNC(=O)c2cccc(C(=O)Nc3ccc(Cl)cc3C)n2)c1.
What is the InChIKey of 6-N-(4-chloro-2-methylphenyl)-2-N-[(3-methylphenyl)methyl]pyridine-2,6-dicarboxamide?
The InChIKey is UQNAVSGGRUNLFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20ClN3O2/c1-14-5-3-6-16(11-14)13-24-21(27)19-7-4-8-20(25-19)22(28)26-18-10-9-17(23)12-15(18)2/h3-12H,13H2,1-2H3,(H,24,27)(H,26,28).
What are the key properties of 6-N-(4-chloro-2-methylphenyl)-2-N-[(3-methylphenyl)methyl]pyridine-2,6-dicarboxamide?
6-N-(4-chloro-2-methylphenyl)-2-N-[(3-methylphenyl)methyl]pyridine-2,6-dicarboxamide has a molecular weight of 393.87 g/mol, XLogP of 4.53, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-(4-chloro-2-methylphenyl)-2-N-[(3-methylphenyl)methyl]pyridine-2,6-dicarboxamide is sourced from PubChem (CID 109097465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).