4-[benzyl(methyl)amino]-N-(3,5-dimethylphenyl)pyridine-2-carboxamide

C22H23N3O — CID 109211059

IUPAC4-[benzyl(methyl)amino]-N-(3,5-dimethylphenyl)pyridine-2-carboxamide
SMILESCc1cc(C)cc(NC(=O)c2cc(N(C)Cc3ccccc3)ccn2)c1
InChIInChI=1S/C22H23N3O/c1-16-11-17(2)13-19(12-16)24-22(26)21-14-20(9-10-23-21)25(3)15-18-7-5-4-6-8-18/h4-14H,15H2,1-3H3,(H,24,26)
InChIKeyRECRXABIJAVHSQ-UHFFFAOYSA-N
MW345.45 g/mol
LogP4.59
Rot. Bonds5

About 4-[benzyl(methyl)amino]-N-(3,5-dimethylphenyl)pyridine-2-carboxamide

4-[benzyl(methyl)amino]-N-(3,5-dimethylphenyl)pyridine-2-carboxamide (PubChem CID 109211059) has the molecular formula C22H23N3O and a molecular weight of 345.45 g/mol. Its IUPAC name is 4-[benzyl(methyl)amino]-N-(3,5-dimethylphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-[benzyl(methyl)amino]-N-(3,5-dimethylphenyl)pyridine-2-carboxamide
PubChem CID109211059
Molecular FormulaC22H23N3O
Molecular Weight345.45 g/mol
Exact Mass345.18
IUPAC Name4-[benzyl(methyl)amino]-N-(3,5-dimethylphenyl)pyridine-2-carboxamide
SMILESCc1cc(C)cc(NC(=O)c2cc(N(C)Cc3ccccc3)ccn2)c1
InChIInChI=1S/C22H23N3O/c1-16-11-17(2)13-19(12-16)24-22(26)21-14-20(9-10-23-21)25(3)15-18-7-5-4-6-8-18/h4-14H,15H2,1-3H3,(H,24,26)
InChIKeyRECRXABIJAVHSQ-UHFFFAOYSA-N
XLogP4.59
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.45
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-N-benzyl-2-N-(3,5-dimethylphenyl)-4-N-methylpyridine-2,4-dicarboxamide
CID 109086206
4-[benzyl(methyl)amino]-N-(2,4-dichlorophenyl)pyridine-2-carboxamide
CID 109211114
N-(1,3-benzodioxol-5-yl)-4-[benzyl(methyl)amino]pyridine-2-carboxamide
CID 109211107
4-[benzyl(methyl)amino]-N-(4-chloro-2-methylphenyl)pyridine-2-carboxamide
CID 109211074
4-[benzyl(methyl)amino]-N-(2-phenylethyl)pyridine-2-carboxamide
CID 109211014
5-[benzyl(methyl)amino]-N-(3,5-dimethylphenyl)pyridine-3-carboxamide
CID 109233203
4-[benzyl(methyl)amino]-N-(2-methoxyethyl)pyridine-2-carboxamide
CID 109205672
N-benzyl-4-[methyl-[[4-(methylcarbamoyl)phenyl]methyl]amino]pyridine-2-carboxamide
CID 75463659
4-[benzyl(propan-2-yl)amino]-N-[4-(dimethylamino)phenyl]pyridine-2-carboxamide
CID 109217263
2-N-benzyl-4-N-(3,5-dimethylphenyl)pyridine-2,4-dicarboxamide
CID 109085444
2-[benzyl(methyl)amino]-N-(3,5-dichlorophenyl)pyrimidine-4-carboxamide
CID 109305096
2-N-(3,5-dimethylphenyl)-4-N-(3-phenylpropyl)pyridine-2,4-dicarboxamide
CID 109089037

Frequently Asked Questions

What is the IUPAC name of 4-[benzyl(methyl)amino]-N-(3,5-dimethylphenyl)pyridine-2-carboxamide?
The IUPAC name of 4-[benzyl(methyl)amino]-N-(3,5-dimethylphenyl)pyridine-2-carboxamide (CID 109211059) is 4-[benzyl(methyl)amino]-N-(3,5-dimethylphenyl)pyridine-2-carboxamide.
What is the SMILES notation for 4-[benzyl(methyl)amino]-N-(3,5-dimethylphenyl)pyridine-2-carboxamide?
The canonical SMILES for 4-[benzyl(methyl)amino]-N-(3,5-dimethylphenyl)pyridine-2-carboxamide is Cc1cc(C)cc(NC(=O)c2cc(N(C)Cc3ccccc3)ccn2)c1.
What is the InChIKey of 4-[benzyl(methyl)amino]-N-(3,5-dimethylphenyl)pyridine-2-carboxamide?
The InChIKey is RECRXABIJAVHSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O/c1-16-11-17(2)13-19(12-16)24-22(26)21-14-20(9-10-23-21)25(3)15-18-7-5-4-6-8-18/h4-14H,15H2,1-3H3,(H,24,26).
What are the key properties of 4-[benzyl(methyl)amino]-N-(3,5-dimethylphenyl)pyridine-2-carboxamide?
4-[benzyl(methyl)amino]-N-(3,5-dimethylphenyl)pyridine-2-carboxamide has a molecular weight of 345.45 g/mol, XLogP of 4.59, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[benzyl(methyl)amino]-N-(3,5-dimethylphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 109211059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).