2-N-(2-chlorophenyl)-4-N-[(2-methylphenyl)methyl]pyridine-2,4-dicarboxamide

C21H18ClN3O2 — CID 109085561

IUPAC2-N-(2-chlorophenyl)-4-N-[(2-methylphenyl)methyl]pyridine-2,4-dicarboxamide
SMILESCc1ccccc1CNC(=O)c1ccnc(C(=O)Nc2ccccc2Cl)c1
InChIInChI=1S/C21H18ClN3O2/c1-14-6-2-3-7-16(14)13-24-20(26)15-10-11-23-19(12-15)21(27)25-18-9-5-4-8-17(18)22/h2-12H,13H2,1H3,(H,24,26)(H,25,27)
InChIKeyYJTVDLCZJSNSBW-UHFFFAOYSA-N
MW379.85 g/mol
LogP4.23
Rot. Bonds5

About 2-N-(2-chlorophenyl)-4-N-[(2-methylphenyl)methyl]pyridine-2,4-dicarboxamide

2-N-(2-chlorophenyl)-4-N-[(2-methylphenyl)methyl]pyridine-2,4-dicarboxamide (PubChem CID 109085561) has the molecular formula C21H18ClN3O2 and a molecular weight of 379.85 g/mol. Its IUPAC name is 2-N-(2-chlorophenyl)-4-N-[(2-methylphenyl)methyl]pyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name2-N-(2-chlorophenyl)-4-N-[(2-methylphenyl)methyl]pyridine-2,4-dicarboxamide
PubChem CID109085561
Molecular FormulaC21H18ClN3O2
Molecular Weight379.85 g/mol
Exact Mass379.11
IUPAC Name2-N-(2-chlorophenyl)-4-N-[(2-methylphenyl)methyl]pyridine-2,4-dicarboxamide
SMILESCc1ccccc1CNC(=O)c1ccnc(C(=O)Nc2ccccc2Cl)c1
InChIInChI=1S/C21H18ClN3O2/c1-14-6-2-3-7-16(14)13-24-20(26)15-10-11-23-19(12-15)21(27)25-18-9-5-4-8-17(18)22/h2-12H,13H2,1H3,(H,24,26)(H,25,27)
InChIKeyYJTVDLCZJSNSBW-UHFFFAOYSA-N
XLogP4.23
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 ≤ 54.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-N-(2-fluorophenyl)-4-N-[(2-methylphenyl)methyl]pyridine-2,4-dicarboxamide
CID 109085559
2-N-(2-cyanophenyl)-4-N-[(2-methylphenyl)methyl]pyridine-2,4-dicarboxamide
CID 109085583
4-N-[(2-methylphenyl)methyl]-2-N-(2,3,4-trifluorophenyl)pyridine-2,4-dicarboxamide
CID 109085587
4-N-(2-chlorophenyl)-2-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide
CID 109092151
2-N-benzyl-4-N-[(2-methylphenyl)methyl]pyridine-2,4-dicarboxamide
CID 109085391
2-N-[(2-methylphenyl)methyl]-4-N-(pyridin-4-ylmethyl)pyridine-2,4-dicarboxamide
CID 109085604
4-N-[(2-chlorophenyl)methyl]-2-N-phenylpyridine-2,4-dicarboxamide
CID 109086644
2-N-[(2-methylphenyl)methyl]-4-N-(2,4,6-trimethylphenyl)pyridine-2,4-dicarboxamide
CID 109085642
4-N-butyl-2-N-[(2-methylphenyl)methyl]pyridine-2,4-dicarboxamide
CID 109079203
4-N-[(2-methylphenyl)methyl]-2-N-pentylpyridine-2,4-dicarboxamide
CID 109085533
4-N-[(2-chlorophenyl)methyl]-2-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2,4-dicarboxamide
CID 109086668
4-N-(2-chlorophenyl)-2-N-(3,4-dimethylphenyl)pyridine-2,4-dicarboxamide
CID 109091921

Frequently Asked Questions

What is the IUPAC name of 2-N-(2-chlorophenyl)-4-N-[(2-methylphenyl)methyl]pyridine-2,4-dicarboxamide?
The IUPAC name of 2-N-(2-chlorophenyl)-4-N-[(2-methylphenyl)methyl]pyridine-2,4-dicarboxamide (CID 109085561) is 2-N-(2-chlorophenyl)-4-N-[(2-methylphenyl)methyl]pyridine-2,4-dicarboxamide.
What is the SMILES notation for 2-N-(2-chlorophenyl)-4-N-[(2-methylphenyl)methyl]pyridine-2,4-dicarboxamide?
The canonical SMILES for 2-N-(2-chlorophenyl)-4-N-[(2-methylphenyl)methyl]pyridine-2,4-dicarboxamide is Cc1ccccc1CNC(=O)c1ccnc(C(=O)Nc2ccccc2Cl)c1.
What is the InChIKey of 2-N-(2-chlorophenyl)-4-N-[(2-methylphenyl)methyl]pyridine-2,4-dicarboxamide?
The InChIKey is YJTVDLCZJSNSBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18ClN3O2/c1-14-6-2-3-7-16(14)13-24-20(26)15-10-11-23-19(12-15)21(27)25-18-9-5-4-8-17(18)22/h2-12H,13H2,1H3,(H,24,26)(H,25,27).
What are the key properties of 2-N-(2-chlorophenyl)-4-N-[(2-methylphenyl)methyl]pyridine-2,4-dicarboxamide?
2-N-(2-chlorophenyl)-4-N-[(2-methylphenyl)methyl]pyridine-2,4-dicarboxamide has a molecular weight of 379.85 g/mol, XLogP of 4.23, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(2-chlorophenyl)-4-N-[(2-methylphenyl)methyl]pyridine-2,4-dicarboxamide is sourced from PubChem (CID 109085561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).