6-N-benzyl-6-N-methyl-2-N-(3-methylphenyl)pyridine-2,6-dicarboxamide

C22H21N3O2 — CID 109097681

IUPAC6-N-benzyl-6-N-methyl-2-N-(3-methylphenyl)pyridine-2,6-dicarboxamide
SMILESCc1cccc(NC(=O)c2cccc(C(=O)N(C)Cc3ccccc3)n2)c1
InChIInChI=1S/C22H21N3O2/c1-16-8-6-11-18(14-16)23-21(26)19-12-7-13-20(24-19)22(27)25(2)15-17-9-4-3-5-10-17/h3-14H,15H2,1-2H3,(H,23,26)
InChIKeyNWFMZPMPQFZCNE-UHFFFAOYSA-N
MW359.43 g/mol
LogP3.91
Rot. Bonds5

About 6-N-benzyl-6-N-methyl-2-N-(3-methylphenyl)pyridine-2,6-dicarboxamide

6-N-benzyl-6-N-methyl-2-N-(3-methylphenyl)pyridine-2,6-dicarboxamide (PubChem CID 109097681) has the molecular formula C22H21N3O2 and a molecular weight of 359.43 g/mol. Its IUPAC name is 6-N-benzyl-6-N-methyl-2-N-(3-methylphenyl)pyridine-2,6-dicarboxamide.

Molecular Properties

Compound Name6-N-benzyl-6-N-methyl-2-N-(3-methylphenyl)pyridine-2,6-dicarboxamide
PubChem CID109097681
Molecular FormulaC22H21N3O2
Molecular Weight359.43 g/mol
Exact Mass359.16
IUPAC Name6-N-benzyl-6-N-methyl-2-N-(3-methylphenyl)pyridine-2,6-dicarboxamide
SMILESCc1cccc(NC(=O)c2cccc(C(=O)N(C)Cc3ccccc3)n2)c1
InChIInChI=1S/C22H21N3O2/c1-16-8-6-11-18(14-16)23-21(26)19-12-7-13-20(24-19)22(27)25(2)15-17-9-4-3-5-10-17/h3-14H,15H2,1-2H3,(H,23,26)
InChIKeyNWFMZPMPQFZCNE-UHFFFAOYSA-N
XLogP3.91
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.43
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-N-(3-methylphenyl)-2-N-phenylpyridine-2,6-dicarboxamide
CID 109099953
3-N-benzyl-3-N-methyl-1-N-(3-methylphenyl)benzene-1,3-dicarboxamide
CID 109054531
6-N-methyl-2-N-(3-methylphenyl)-6-N-phenylpyridine-2,6-dicarboxamide
CID 109100104
6-N-benzyl-6-N-methyl-2-N-(4-propan-2-ylphenyl)pyridine-2,6-dicarboxamide
CID 109097697
N-benzyl-N-methyl-2-(3-methylanilino)pyrimidine-4-carboxamide
CID 109305156
N-benzyl-N-methyl-5-(3-methylanilino)pyrazine-2-carboxamide
CID 109281070
6-N-benzyl-6-N-methyl-2-N-(pyridin-4-ylmethyl)pyridine-2,6-dicarboxamide
CID 109097660
3-benzamido-N-benzyl-N-methylbenzamide
CID 3936845
4-N-benzyl-2-N-(3,5-dimethylphenyl)-4-N-methylpyridine-2,4-dicarboxamide
CID 109086206
6-N-(3,5-dimethylphenyl)-2-N-(2-phenylethyl)pyridine-2,6-dicarboxamide
CID 109098441
6-N-benzyl-2-N-(3-fluorophenyl)-6-N-propan-2-ylpyridine-2,6-dicarboxamide
CID 109099326
6-N-(2-fluorophenyl)-2-N-(3-methylphenyl)pyridine-2,6-dicarboxamide
CID 109100120

Frequently Asked Questions

What is the IUPAC name of 6-N-benzyl-6-N-methyl-2-N-(3-methylphenyl)pyridine-2,6-dicarboxamide?
The IUPAC name of 6-N-benzyl-6-N-methyl-2-N-(3-methylphenyl)pyridine-2,6-dicarboxamide (CID 109097681) is 6-N-benzyl-6-N-methyl-2-N-(3-methylphenyl)pyridine-2,6-dicarboxamide.
What is the SMILES notation for 6-N-benzyl-6-N-methyl-2-N-(3-methylphenyl)pyridine-2,6-dicarboxamide?
The canonical SMILES for 6-N-benzyl-6-N-methyl-2-N-(3-methylphenyl)pyridine-2,6-dicarboxamide is Cc1cccc(NC(=O)c2cccc(C(=O)N(C)Cc3ccccc3)n2)c1.
What is the InChIKey of 6-N-benzyl-6-N-methyl-2-N-(3-methylphenyl)pyridine-2,6-dicarboxamide?
The InChIKey is NWFMZPMPQFZCNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O2/c1-16-8-6-11-18(14-16)23-21(26)19-12-7-13-20(24-19)22(27)25(2)15-17-9-4-3-5-10-17/h3-14H,15H2,1-2H3,(H,23,26).
What are the key properties of 6-N-benzyl-6-N-methyl-2-N-(3-methylphenyl)pyridine-2,6-dicarboxamide?
6-N-benzyl-6-N-methyl-2-N-(3-methylphenyl)pyridine-2,6-dicarboxamide has a molecular weight of 359.43 g/mol, XLogP of 3.91, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-benzyl-6-N-methyl-2-N-(3-methylphenyl)pyridine-2,6-dicarboxamide is sourced from PubChem (CID 109097681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).