4-methyl-6-(4-methylimidazol-1-yl)-N-(4-methylphenyl)pyridine-2-carboxamide

C18H18N4O — CID 160560105

IUPAC4-methyl-6-(4-methylimidazol-1-yl)-N-(4-methylphenyl)pyridine-2-carboxamide
SMILESCc1ccc(NC(=O)c2cc(C)cc(-n3cnc(C)c3)n2)cc1
InChIInChI=1S/C18H18N4O/c1-12-4-6-15(7-5-12)20-18(23)16-8-13(2)9-17(21-16)22-10-14(3)19-11-22/h4-11H,1-3H3,(H,20,23)
InChIKeyJNOIOPZLQHDZFV-UHFFFAOYSA-N
MW306.37 g/mol
LogP3.44
Rot. Bonds3

About 4-methyl-6-(4-methylimidazol-1-yl)-N-(4-methylphenyl)pyridine-2-carboxamide

4-methyl-6-(4-methylimidazol-1-yl)-N-(4-methylphenyl)pyridine-2-carboxamide (PubChem CID 160560105) has the molecular formula C18H18N4O and a molecular weight of 306.37 g/mol. Its IUPAC name is 4-methyl-6-(4-methylimidazol-1-yl)-N-(4-methylphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-methyl-6-(4-methylimidazol-1-yl)-N-(4-methylphenyl)pyridine-2-carboxamide
PubChem CID160560105
Molecular FormulaC18H18N4O
Molecular Weight306.37 g/mol
Exact Mass306.15
IUPAC Name4-methyl-6-(4-methylimidazol-1-yl)-N-(4-methylphenyl)pyridine-2-carboxamide
SMILESCc1ccc(NC(=O)c2cc(C)cc(-n3cnc(C)c3)n2)cc1
InChIInChI=1S/C18H18N4O/c1-12-4-6-15(7-5-12)20-18(23)16-8-13(2)9-17(21-16)22-10-14(3)19-11-22/h4-11H,1-3H3,(H,20,23)
InChIKeyJNOIOPZLQHDZFV-UHFFFAOYSA-N
XLogP3.44
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-6-(4-methylimidazol-1-yl)-N-(4-methylphenyl)pyridine-2-carboxamide?
The IUPAC name of 4-methyl-6-(4-methylimidazol-1-yl)-N-(4-methylphenyl)pyridine-2-carboxamide (CID 160560105) is 4-methyl-6-(4-methylimidazol-1-yl)-N-(4-methylphenyl)pyridine-2-carboxamide.
What is the SMILES notation for 4-methyl-6-(4-methylimidazol-1-yl)-N-(4-methylphenyl)pyridine-2-carboxamide?
The canonical SMILES for 4-methyl-6-(4-methylimidazol-1-yl)-N-(4-methylphenyl)pyridine-2-carboxamide is Cc1ccc(NC(=O)c2cc(C)cc(-n3cnc(C)c3)n2)cc1.
What is the InChIKey of 4-methyl-6-(4-methylimidazol-1-yl)-N-(4-methylphenyl)pyridine-2-carboxamide?
The InChIKey is JNOIOPZLQHDZFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O/c1-12-4-6-15(7-5-12)20-18(23)16-8-13(2)9-17(21-16)22-10-14(3)19-11-22/h4-11H,1-3H3,(H,20,23).
What are the key properties of 4-methyl-6-(4-methylimidazol-1-yl)-N-(4-methylphenyl)pyridine-2-carboxamide?
4-methyl-6-(4-methylimidazol-1-yl)-N-(4-methylphenyl)pyridine-2-carboxamide has a molecular weight of 306.37 g/mol, XLogP of 3.44, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-6-(4-methylimidazol-1-yl)-N-(4-methylphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 160560105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).