5-[benzyl(methyl)amino]-N-(2,5-dichlorophenyl)pyridine-2-carboxamide

C20H17Cl2N3O — CID 109189327

IUPAC5-[benzyl(methyl)amino]-N-(2,5-dichlorophenyl)pyridine-2-carboxamide
SMILESCN(Cc1ccccc1)c1ccc(C(=O)Nc2cc(Cl)ccc2Cl)nc1
InChIInChI=1S/C20H17Cl2N3O/c1-25(13-14-5-3-2-4-6-14)16-8-10-18(23-12-16)20(26)24-19-11-15(21)7-9-17(19)22/h2-12H,13H2,1H3,(H,24,26)
InChIKeyLIVBEULYRJAWHZ-UHFFFAOYSA-N
MW386.28 g/mol
LogP5.28
Rot. Bonds5

About 5-[benzyl(methyl)amino]-N-(2,5-dichlorophenyl)pyridine-2-carboxamide

5-[benzyl(methyl)amino]-N-(2,5-dichlorophenyl)pyridine-2-carboxamide (PubChem CID 109189327) has the molecular formula C20H17Cl2N3O and a molecular weight of 386.28 g/mol. Its IUPAC name is 5-[benzyl(methyl)amino]-N-(2,5-dichlorophenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-[benzyl(methyl)amino]-N-(2,5-dichlorophenyl)pyridine-2-carboxamide
PubChem CID109189327
Molecular FormulaC20H17Cl2N3O
Molecular Weight386.28 g/mol
Exact Mass385.07
IUPAC Name5-[benzyl(methyl)amino]-N-(2,5-dichlorophenyl)pyridine-2-carboxamide
SMILESCN(Cc1ccccc1)c1ccc(C(=O)Nc2cc(Cl)ccc2Cl)nc1
InChIInChI=1S/C20H17Cl2N3O/c1-25(13-14-5-3-2-4-6-14)16-8-10-18(23-12-16)20(26)24-19-11-15(21)7-9-17(19)22/h2-12H,13H2,1H3,(H,24,26)
InChIKeyLIVBEULYRJAWHZ-UHFFFAOYSA-N
XLogP5.28
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500386.28
LogP ≤ 55.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,5-dichlorophenyl)-5-(N-methylanilino)pyridine-2-carboxamide
CID 109197716
4-[benzyl(methyl)amino]-N-(2,4-dichlorophenyl)pyridine-2-carboxamide
CID 109211114
4-[benzyl(methyl)amino]-N-(4-chloro-2-methylphenyl)pyridine-2-carboxamide
CID 109211074
5-[benzyl(methyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2-carboxamide
CID 109189340
5-[benzyl(methyl)amino]-N-cyclopropylpyridine-2-carboxamide
CID 109179860
N-(1,3-benzodioxol-5-yl)-5-[benzyl(methyl)amino]pyridine-2-carboxamide
CID 109189319
N'-benzyl-N-(2,5-dichlorophenyl)-N'-ethyloxamide
CID 108500995
5-[benzyl(methyl)amino]-N-cycloheptylpyridine-2-carboxamide
CID 109189250
2-[benzyl(methyl)amino]-N-(2,4-dichlorophenyl)pyrimidine-4-carboxamide
CID 109305094
N-(2,5-dichlorophenyl)-5-[(3-methylphenyl)methylamino]pyrazine-2-carboxamide
CID 109280476
5-[benzyl(methyl)amino]-N-[2-(3-methoxyphenyl)ethyl]pyridine-2-carboxamide
CID 109189231
5-[benzyl(methyl)amino]-N-[(3,4-dimethoxyphenyl)methyl]pyridine-2-carboxamide
CID 109189239

Frequently Asked Questions

What is the IUPAC name of 5-[benzyl(methyl)amino]-N-(2,5-dichlorophenyl)pyridine-2-carboxamide?
The IUPAC name of 5-[benzyl(methyl)amino]-N-(2,5-dichlorophenyl)pyridine-2-carboxamide (CID 109189327) is 5-[benzyl(methyl)amino]-N-(2,5-dichlorophenyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-[benzyl(methyl)amino]-N-(2,5-dichlorophenyl)pyridine-2-carboxamide?
The canonical SMILES for 5-[benzyl(methyl)amino]-N-(2,5-dichlorophenyl)pyridine-2-carboxamide is CN(Cc1ccccc1)c1ccc(C(=O)Nc2cc(Cl)ccc2Cl)nc1.
What is the InChIKey of 5-[benzyl(methyl)amino]-N-(2,5-dichlorophenyl)pyridine-2-carboxamide?
The InChIKey is LIVBEULYRJAWHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17Cl2N3O/c1-25(13-14-5-3-2-4-6-14)16-8-10-18(23-12-16)20(26)24-19-11-15(21)7-9-17(19)22/h2-12H,13H2,1H3,(H,24,26).
What are the key properties of 5-[benzyl(methyl)amino]-N-(2,5-dichlorophenyl)pyridine-2-carboxamide?
5-[benzyl(methyl)amino]-N-(2,5-dichlorophenyl)pyridine-2-carboxamide has a molecular weight of 386.28 g/mol, XLogP of 5.28, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[benzyl(methyl)amino]-N-(2,5-dichlorophenyl)pyridine-2-carboxamide is sourced from PubChem (CID 109189327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).