2,4-dimethyl-6-(2-methylphenyl)-3-(2-methylpyrazol-2-ium-1-yl)pyridine;2,4-dimethyl-3-(2-methyl-4-phenylpyrazol-2-ium-1-yl)pyridine;3-[4-(2,6-dimethylphenyl)-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine;3-[4-(2,6-diphenylphenyl)-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine;3-[4-[2,6-di(propan-2-yl)phenyl]-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine

C106H116N15+5 — CID 157321451

About 2,4-dimethyl-6-(2-methylphenyl)-3-(2-methylpyrazol-2-ium-1-yl)pyridine;2,4-dimethyl-3-(2-methyl-4-phenylpyrazol-2-ium-1-yl)pyridine;3-[4-(2,6-dimethylphenyl)-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine;3-[4-(2,6-diphenylphenyl)-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine;3-[4-[2,6-di(propan-2-yl)phenyl]-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine

2,4-dimethyl-6-(2-methylphenyl)-3-(2-methylpyrazol-2-ium-1-yl)pyridine;2,4-dimethyl-3-(2-methyl-4-phenylpyrazol-2-ium-1-yl)pyridine;3-[4-(2,6-dimethylphenyl)-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine;3-[4-(2,6-diphenylphenyl)-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine;3-[4-[2,6-di(propan-2-yl)phenyl]-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine (PubChem CID 157321451) has the molecular formula C106H116N15+5 and a molecular weight of 1600.20 g/mol. Its IUPAC name is 2,4-dimethyl-6-(2-methylphenyl)-3-(2-methylpyrazol-2-ium-1-yl)pyridine;2,4-dimethyl-3-(2-methyl-4-phenylpyrazol-2-ium-1-yl)pyridine;3-[4-(2,6-dimethylphenyl)-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine;3-[4-(2,6-diphenylphenyl)-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine;3-[4-[2,6-di(propan-2-yl)phenyl]-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine.

Molecular Properties

• Compound Name: 2,4-dimethyl-6-(2-methylphenyl)-3-(2-methylpyrazol-2-ium-1-yl)pyridine;2,4-dimethyl-3-(2-methyl-4-phenylpyrazol-2-ium-1-yl)pyridine;3-[4-(2,6-dimethylphenyl)-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine;3-[4-(2,6-diphenylphenyl)-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine;3-[4-[2,6-di(propan-2-yl)phenyl]-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine
• PubChem CID: 157321451
• Molecular Formula: C106H116N15+5
• Molecular Weight: 1600.20 g/mol
• Exact Mass: 1598.95
• IUPAC Name: 2,4-dimethyl-6-(2-methylphenyl)-3-(2-methylpyrazol-2-ium-1-yl)pyridine;2,4-dimethyl-3-(2-methyl-4-phenylpyrazol-2-ium-1-yl)pyridine;3-[4-(2,6-dimethylphenyl)-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine;3-[4-(2,6-diphenylphenyl)-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine;3-[4-[2,6-di(propan-2-yl)phenyl]-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine
• SMILES: Cc1cccc(C)c1-c1cn(-c2c(C)ccnc2C)[n+](C)c1.Cc1ccccc1-c1cc(C)c(-n2ccc[n+]2C)c(C)n1.Cc1ccnc(C)c1-n1cc(-c2c(-c3ccccc3)cccc2-c2ccccc2)c[n+]1C.Cc1ccnc(C)c1-n1cc(-c2c(C(C)C)cccc2C(C)C)c[n+]1C.Cc1ccnc(C)c1-n1cc(-c2ccccc2)c[n+]1C
• InChI: InChI=1S/C29H26N3.C23H30N3.C19H22N3.C18H20N3.C17H18N3/c1-21-17-18-30-22(2)29(21)32-20-25(19-31(32)3)28-26(23-11-6-4-7-12-23)15-10-16-27(28)24-13-8-5-9-14-24;1-15(2)20-9-8-10-21(16(3)4)22(20)19-13-25(7)26(14-19)23-17(5)11-12-24-18(23)6;1-13-7-6-8-14(2)18(13)17-11-21(5)22(12-17)19-15(3)9-10-20-16(19)4;1-13-8-5-6-9-16(13)17-12-14(2)18(15(3)19-17)21-11-7-10-20(21)4;1-13-9-10-18-14(2)17(13)20-12-16(11-19(20)3)15-7-5-4-6-8-15/h4-20H,1-3H3;8-16H,1-7H3;6-12H,1-5H3;5-12H,1-4H3;4-12H,1-3H3/q5*+1
• InChIKey: VYEZVANFQZQJFY-UHFFFAOYSA-N
• XLogP: 21.41
• TPSA: 108.50 Ų
• H-Bond Acceptors: 10
• Rotatable Bonds: 14
• Heavy Atoms: 121
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1600.20
LogP ≤ 5	21.41
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	10

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-6-(2-methylphenyl)-3-(2-methylpyrazol-2-ium-1-yl)pyridine;2,4-dimethyl-3-(2-methyl-4-phenylpyrazol-2-ium-1-yl)pyridine;3-[4-(2,6-dimethylphenyl)-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine;3-[4-(2,6-diphenylphenyl)-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine;3-[4-[2,6-di(propan-2-yl)phenyl]-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine?

The IUPAC name of 2,4-dimethyl-6-(2-methylphenyl)-3-(2-methylpyrazol-2-ium-1-yl)pyridine;2,4-dimethyl-3-(2-methyl-4-phenylpyrazol-2-ium-1-yl)pyridine;3-[4-(2,6-dimethylphenyl)-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine;3-[4-(2,6-diphenylphenyl)-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine;3-[4-[2,6-di(propan-2-yl)phenyl]-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine (CID 157321451) is 2,4-dimethyl-6-(2-methylphenyl)-3-(2-methylpyrazol-2-ium-1-yl)pyridine;2,4-dimethyl-3-(2-methyl-4-phenylpyrazol-2-ium-1-yl)pyridine;3-[4-(2,6-dimethylphenyl)-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine;3-[4-(2,6-diphenylphenyl)-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine;3-[4-[2,6-di(propan-2-yl)phenyl]-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine.

What is the SMILES notation for 2,4-dimethyl-6-(2-methylphenyl)-3-(2-methylpyrazol-2-ium-1-yl)pyridine;2,4-dimethyl-3-(2-methyl-4-phenylpyrazol-2-ium-1-yl)pyridine;3-[4-(2,6-dimethylphenyl)-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine;3-[4-(2,6-diphenylphenyl)-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine;3-[4-[2,6-di(propan-2-yl)phenyl]-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine?

The canonical SMILES for 2,4-dimethyl-6-(2-methylphenyl)-3-(2-methylpyrazol-2-ium-1-yl)pyridine;2,4-dimethyl-3-(2-methyl-4-phenylpyrazol-2-ium-1-yl)pyridine;3-[4-(2,6-dimethylphenyl)-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine;3-[4-(2,6-diphenylphenyl)-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine;3-[4-[2,6-di(propan-2-yl)phenyl]-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine is Cc1cccc(C)c1-c1cn(-c2c(C)ccnc2C)[n+](C)c1.Cc1ccccc1-c1cc(C)c(-n2ccc[n+]2C)c(C)n1.Cc1ccnc(C)c1-n1cc(-c2c(-c3ccccc3)cccc2-c2ccccc2)c[n+]1C.Cc1ccnc(C)c1-n1cc(-c2c(C(C)C)cccc2C(C)C)c[n+]1C.Cc1ccnc(C)c1-n1cc(-c2ccccc2)c[n+]1C.

What is the InChIKey of 2,4-dimethyl-6-(2-methylphenyl)-3-(2-methylpyrazol-2-ium-1-yl)pyridine;2,4-dimethyl-3-(2-methyl-4-phenylpyrazol-2-ium-1-yl)pyridine;3-[4-(2,6-dimethylphenyl)-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine;3-[4-(2,6-diphenylphenyl)-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine;3-[4-[2,6-di(propan-2-yl)phenyl]-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine?

The InChIKey is VYEZVANFQZQJFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H26N3.C23H30N3.C19H22N3.C18H20N3.C17H18N3/c1-21-17-18-30-22(2)29(21)32-20-25(19-31(32)3)28-26(23-11-6-4-7-12-23)15-10-16-27(28)24-13-8-5-9-14-24;1-15(2)20-9-8-10-21(16(3)4)22(20)19-13-25(7)26(14-19)23-17(5)11-12-24-18(23)6;1-13-7-6-8-14(2)18(13)17-11-21(5)22(12-17)19-15(3)9-10-20-16(19)4;1-13-8-5-6-9-16(13)17-12-14(2)18(15(3)19-17)21-11-7-10-20(21)4;1-13-9-10-18-14(2)17(13)20-12-16(11-19(20)3)15-7-5-4-6-8-15/h4-20H,1-3H3;8-16H,1-7H3;6-12H,1-5H3;5-12H,1-4H3;4-12H,1-3H3/q5*+1.

What are the key properties of 2,4-dimethyl-6-(2-methylphenyl)-3-(2-methylpyrazol-2-ium-1-yl)pyridine;2,4-dimethyl-3-(2-methyl-4-phenylpyrazol-2-ium-1-yl)pyridine;3-[4-(2,6-dimethylphenyl)-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine;3-[4-(2,6-diphenylphenyl)-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine;3-[4-[2,6-di(propan-2-yl)phenyl]-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine?

2,4-dimethyl-6-(2-methylphenyl)-3-(2-methylpyrazol-2-ium-1-yl)pyridine;2,4-dimethyl-3-(2-methyl-4-phenylpyrazol-2-ium-1-yl)pyridine;3-[4-(2,6-dimethylphenyl)-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine;3-[4-(2,6-diphenylphenyl)-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine;3-[4-[2,6-di(propan-2-yl)phenyl]-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine has a molecular weight of 1600.20 g/mol, XLogP of 21.41, 14 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for 2,4-dimethyl-6-(2-methylphenyl)-3-(2-methylpyrazol-2-ium-1-yl)pyridine;2,4-dimethyl-3-(2-methyl-4-phenylpyrazol-2-ium-1-yl)pyridine;3-[4-(2,6-dimethylphenyl)-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine;3-[4-(2,6-diphenylphenyl)-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine;3-[4-[2,6-di(propan-2-yl)phenyl]-2-methylpyrazol-2-ium-1-yl]-2,4-dimethylpyridine is sourced from PubChem (CID 157321451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).