4-cyclohexyl-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;4-cyclopentyl-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;4-(2,2-dimethylpropyl)-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]-4-(2-methylpropyl)pyridin-1-ium;1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]-4-propan-2-ylpyridin-1-ium

C123H142N5+5 — CID 157202209

About 4-cyclohexyl-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;4-cyclopentyl-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;4-(2,2-dimethylpropyl)-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]-4-(2-methylpropyl)pyridin-1-ium;1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]-4-propan-2-ylpyridin-1-ium

4-cyclohexyl-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;4-cyclopentyl-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;4-(2,2-dimethylpropyl)-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]-4-(2-methylpropyl)pyridin-1-ium;1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]-4-propan-2-ylpyridin-1-ium (PubChem CID 157202209) has the molecular formula C123H142N5+5 and a molecular weight of 1690.52 g/mol. Its IUPAC name is 4-cyclohexyl-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;4-cyclopentyl-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;4-(2,2-dimethylpropyl)-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]-4-(2-methylpropyl)pyridin-1-ium;1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]-4-propan-2-ylpyridin-1-ium.

Molecular Properties

• Compound Name: 4-cyclohexyl-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;4-cyclopentyl-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;4-(2,2-dimethylpropyl)-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]-4-(2-methylpropyl)pyridin-1-ium;1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]-4-propan-2-ylpyridin-1-ium
• PubChem CID: 157202209
• Molecular Formula: C123H142N5+5
• Molecular Weight: 1690.52 g/mol
• Exact Mass: 1689.12
• IUPAC Name: 4-cyclohexyl-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;4-cyclopentyl-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;4-(2,2-dimethylpropyl)-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]-4-(2-methylpropyl)pyridin-1-ium;1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]-4-propan-2-ylpyridin-1-ium
• SMILES: Cc1ccccc1-c1ccc(C)c(-c2cc(C(C)C)cc[n+]2C)c1.Cc1ccccc1-c1ccc(C)c(-c2cc(C3CCCC3)cc[n+]2C)c1.Cc1ccccc1-c1ccc(C)c(-c2cc(C3CCCCC3)cc[n+]2C)c1.Cc1ccccc1-c1ccc(C)c(-c2cc(CC(C)(C)C)cc[n+]2C)c1.Cc1ccccc1-c1ccc(C)c(-c2cc(CC(C)C)cc[n+]2C)c1
• InChI: InChI=1S/C26H30N.C25H28N.C25H30N.C24H28N.C23H26N/c1-19-9-7-8-12-24(19)23-14-13-20(2)25(17-23)26-18-22(15-16-27(26)3)21-10-5-4-6-11-21;1-18-8-4-7-11-23(18)22-13-12-19(2)24(16-22)25-17-21(14-15-26(25)3)20-9-5-6-10-20;1-18-9-7-8-10-22(18)21-12-11-19(2)23(16-21)24-15-20(13-14-26(24)6)17-25(3,4)5;1-17(2)14-20-12-13-25(5)24(15-20)23-16-21(11-10-19(23)4)22-9-7-6-8-18(22)3;1-16(2)19-12-13-24(5)23(15-19)22-14-20(11-10-18(22)4)21-9-7-6-8-17(21)3/h7-9,12-18,21H,4-6,10-11H2,1-3H3;4,7-8,11-17,20H,5-6,9-10H2,1-3H3;7-16H,17H2,1-6H3;6-13,15-17H,14H2,1-5H3;6-16H,1-5H3/q5*+1
• InChIKey: XKMLVWZCHWEFHX-UHFFFAOYSA-N
• XLogP: 29.93
• TPSA: 19.40 Ų
• Rotatable Bonds: 16
• Heavy Atoms: 128
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1690.52
LogP ≤ 5	29.93
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	0

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyl-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;4-cyclopentyl-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;4-(2,2-dimethylpropyl)-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]-4-(2-methylpropyl)pyridin-1-ium;1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]-4-propan-2-ylpyridin-1-ium?

The IUPAC name of 4-cyclohexyl-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;4-cyclopentyl-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;4-(2,2-dimethylpropyl)-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]-4-(2-methylpropyl)pyridin-1-ium;1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]-4-propan-2-ylpyridin-1-ium (CID 157202209) is 4-cyclohexyl-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;4-cyclopentyl-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;4-(2,2-dimethylpropyl)-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]-4-(2-methylpropyl)pyridin-1-ium;1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]-4-propan-2-ylpyridin-1-ium.

What is the SMILES notation for 4-cyclohexyl-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;4-cyclopentyl-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;4-(2,2-dimethylpropyl)-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]-4-(2-methylpropyl)pyridin-1-ium;1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]-4-propan-2-ylpyridin-1-ium?

The canonical SMILES for 4-cyclohexyl-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;4-cyclopentyl-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;4-(2,2-dimethylpropyl)-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]-4-(2-methylpropyl)pyridin-1-ium;1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]-4-propan-2-ylpyridin-1-ium is Cc1ccccc1-c1ccc(C)c(-c2cc(C(C)C)cc[n+]2C)c1.Cc1ccccc1-c1ccc(C)c(-c2cc(C3CCCC3)cc[n+]2C)c1.Cc1ccccc1-c1ccc(C)c(-c2cc(C3CCCCC3)cc[n+]2C)c1.Cc1ccccc1-c1ccc(C)c(-c2cc(CC(C)(C)C)cc[n+]2C)c1.Cc1ccccc1-c1ccc(C)c(-c2cc(CC(C)C)cc[n+]2C)c1.

What is the InChIKey of 4-cyclohexyl-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;4-cyclopentyl-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;4-(2,2-dimethylpropyl)-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]-4-(2-methylpropyl)pyridin-1-ium;1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]-4-propan-2-ylpyridin-1-ium?

The InChIKey is XKMLVWZCHWEFHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H30N.C25H28N.C25H30N.C24H28N.C23H26N/c1-19-9-7-8-12-24(19)23-14-13-20(2)25(17-23)26-18-22(15-16-27(26)3)21-10-5-4-6-11-21;1-18-8-4-7-11-23(18)22-13-12-19(2)24(16-22)25-17-21(14-15-26(25)3)20-9-5-6-10-20;1-18-9-7-8-10-22(18)21-12-11-19(2)23(16-21)24-15-20(13-14-26(24)6)17-25(3,4)5;1-17(2)14-20-12-13-25(5)24(15-20)23-16-21(11-10-19(23)4)22-9-7-6-8-18(22)3;1-16(2)19-12-13-24(5)23(15-19)22-14-20(11-10-18(22)4)21-9-7-6-8-17(21)3/h7-9,12-18,21H,4-6,10-11H2,1-3H3;4,7-8,11-17,20H,5-6,9-10H2,1-3H3;7-16H,17H2,1-6H3;6-13,15-17H,14H2,1-5H3;6-16H,1-5H3/q5*+1.

What are the key properties of 4-cyclohexyl-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;4-cyclopentyl-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;4-(2,2-dimethylpropyl)-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]-4-(2-methylpropyl)pyridin-1-ium;1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]-4-propan-2-ylpyridin-1-ium?

4-cyclohexyl-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;4-cyclopentyl-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;4-(2,2-dimethylpropyl)-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]-4-(2-methylpropyl)pyridin-1-ium;1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]-4-propan-2-ylpyridin-1-ium has a molecular weight of 1690.52 g/mol, XLogP of 29.93, 16 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for 4-cyclohexyl-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;4-cyclopentyl-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;4-(2,2-dimethylpropyl)-1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]pyridin-1-ium;1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]-4-(2-methylpropyl)pyridin-1-ium;1-methyl-2-[2-methyl-5-(2-methylphenyl)phenyl]-4-propan-2-ylpyridin-1-ium is sourced from PubChem (CID 157202209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).