2-(2,4-dimethylphenyl)-1,3,5,6-tetramethylpyrazin-1-ium;2-(4-methoxy-2-methylphenyl)-1,3,5,6-tetramethylpyrazin-1-ium;3-methyl-N,N-diphenyl-4-(1,3,6-trimethylpyrazin-1-ium-2-yl)aniline;6-methyl-7-(1,3,6-trimethylpyrazin-1-ium-2-yl)-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8-triene;1,2,3,5-tetramethyl-6-(2-methylphenyl)pyrazin-1-ium;1,3,6-trimethyl-2-(3-methylnaphthalen-2-yl)pyrazin-1-ium;1,3,6-trimethyl-2-(3'-methyl-9,9'-spirobi[fluorene]-2'-yl)pyrazin-1-ium;1,3,6-trimethyl-2-(3,9,9-trimethylfluoren-2-yl)pyrazin-1-ium;N,N,3-trimethyl-4-(1,3,6-trimethylpyrazin-1-ium-2-yl)aniline

C183H206N21O+9 — CID 160553797

About 2-(2,4-dimethylphenyl)-1,3,5,6-tetramethylpyrazin-1-ium;2-(4-methoxy-2-methylphenyl)-1,3,5,6-tetramethylpyrazin-1-ium;3-methyl-N,N-diphenyl-4-(1,3,6-trimethylpyrazin-1-ium-2-yl)aniline;6-methyl-7-(1,3,6-trimethylpyrazin-1-ium-2-yl)-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8-triene;1,2,3,5-tetramethyl-6-(2-methylphenyl)pyrazin-1-ium;1,3,6-trimethyl-2-(3-methylnaphthalen-2-yl)pyrazin-1-ium;1,3,6-trimethyl-2-(3'-methyl-9,9'-spirobi[fluorene]-2'-yl)pyrazin-1-ium;1,3,6-trimethyl-2-(3,9,9-trimethylfluoren-2-yl)pyrazin-1-ium;N,N,3-trimethyl-4-(1,3,6-trimethylpyrazin-1-ium-2-yl)aniline

2-(2,4-dimethylphenyl)-1,3,5,6-tetramethylpyrazin-1-ium;2-(4-methoxy-2-methylphenyl)-1,3,5,6-tetramethylpyrazin-1-ium;3-methyl-N,N-diphenyl-4-(1,3,6-trimethylpyrazin-1-ium-2-yl)aniline;6-methyl-7-(1,3,6-trimethylpyrazin-1-ium-2-yl)-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8-triene;1,2,3,5-tetramethyl-6-(2-methylphenyl)pyrazin-1-ium;1,3,6-trimethyl-2-(3-methylnaphthalen-2-yl)pyrazin-1-ium;1,3,6-trimethyl-2-(3'-methyl-9,9'-spirobi[fluorene]-2'-yl)pyrazin-1-ium;1,3,6-trimethyl-2-(3,9,9-trimethylfluoren-2-yl)pyrazin-1-ium;N,N,3-trimethyl-4-(1,3,6-trimethylpyrazin-1-ium-2-yl)aniline (PubChem CID 160553797) has the molecular formula C183H206N21O+9 and a molecular weight of 2715.81 g/mol. Its IUPAC name is 2-(2,4-dimethylphenyl)-1,3,5,6-tetramethylpyrazin-1-ium;2-(4-methoxy-2-methylphenyl)-1,3,5,6-tetramethylpyrazin-1-ium;3-methyl-N,N-diphenyl-4-(1,3,6-trimethylpyrazin-1-ium-2-yl)aniline;6-methyl-7-(1,3,6-trimethylpyrazin-1-ium-2-yl)-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8-triene;1,2,3,5-tetramethyl-6-(2-methylphenyl)pyrazin-1-ium;1,3,6-trimethyl-2-(3-methylnaphthalen-2-yl)pyrazin-1-ium;1,3,6-trimethyl-2-(3'-methyl-9,9'-spirobi[fluorene]-2'-yl)pyrazin-1-ium;1,3,6-trimethyl-2-(3,9,9-trimethylfluoren-2-yl)pyrazin-1-ium;N,N,3-trimethyl-4-(1,3,6-trimethylpyrazin-1-ium-2-yl)aniline.

Molecular Properties

• Compound Name: 2-(2,4-dimethylphenyl)-1,3,5,6-tetramethylpyrazin-1-ium;2-(4-methoxy-2-methylphenyl)-1,3,5,6-tetramethylpyrazin-1-ium;3-methyl-N,N-diphenyl-4-(1,3,6-trimethylpyrazin-1-ium-2-yl)aniline;6-methyl-7-(1,3,6-trimethylpyrazin-1-ium-2-yl)-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8-triene;1,2,3,5-tetramethyl-6-(2-methylphenyl)pyrazin-1-ium;1,3,6-trimethyl-2-(3-methylnaphthalen-2-yl)pyrazin-1-ium;1,3,6-trimethyl-2-(3'-methyl-9,9'-spirobi[fluorene]-2'-yl)pyrazin-1-ium;1,3,6-trimethyl-2-(3,9,9-trimethylfluoren-2-yl)pyrazin-1-ium;N,N,3-trimethyl-4-(1,3,6-trimethylpyrazin-1-ium-2-yl)aniline
• PubChem CID: 160553797
• Molecular Formula: C183H206N21O+9
• Molecular Weight: 2715.81 g/mol
• Exact Mass: 2713.67
• IUPAC Name: 2-(2,4-dimethylphenyl)-1,3,5,6-tetramethylpyrazin-1-ium;2-(4-methoxy-2-methylphenyl)-1,3,5,6-tetramethylpyrazin-1-ium;3-methyl-N,N-diphenyl-4-(1,3,6-trimethylpyrazin-1-ium-2-yl)aniline;6-methyl-7-(1,3,6-trimethylpyrazin-1-ium-2-yl)-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8-triene;1,2,3,5-tetramethyl-6-(2-methylphenyl)pyrazin-1-ium;1,3,6-trimethyl-2-(3-methylnaphthalen-2-yl)pyrazin-1-ium;1,3,6-trimethyl-2-(3'-methyl-9,9'-spirobi[fluorene]-2'-yl)pyrazin-1-ium;1,3,6-trimethyl-2-(3,9,9-trimethylfluoren-2-yl)pyrazin-1-ium;N,N,3-trimethyl-4-(1,3,6-trimethylpyrazin-1-ium-2-yl)aniline
• SMILES: COc1ccc(-c2c(C)nc(C)c(C)[n+]2C)c(C)c1.Cc1cc(N(C)C)ccc1-c1c(C)ncc(C)[n+]1C.Cc1cc(N(c2ccccc2)c2ccccc2)ccc1-c1c(C)ncc(C)[n+]1C.Cc1cc2c(cc1-c1c(C)ncc(C)[n+]1C)C(C)(C)c1ccccc1-2.Cc1cc2c(cc1-c1c(C)ncc(C)[n+]1C)C1(c3ccccc3-c3ccccc31)c1ccccc1-2.Cc1cc2ccccc2cc1-c1c(C)ncc(C)[n+]1C.Cc1ccc(-c2c(C)nc(C)c(C)[n+]2C)c(C)c1.Cc1ccccc1-c1c(C)nc(C)c(C)[n+]1C.Cc1ncc(C)[n+](C)c1-c1cc2c3c(c1C)CCCN3CCC2
• InChI: InChI=1S/C33H27N2.C26H26N3.C23H25N2.C20H26N3.C18H19N2.C16H22N3.C16H21N2O.C16H21N2.C15H19N2/c1-20-17-27-25-13-7-10-16-30(25)33(28-14-8-5-11-23(28)24-12-6-9-15-29(24)33)31(27)18-26(20)32-22(3)34-19-21(2)35(32)4;1-19-17-24(15-16-25(19)26-21(3)27-18-20(2)28(26)4)29(22-11-7-5-8-12-22)23-13-9-6-10-14-23;1-14-11-19-17-9-7-8-10-20(17)23(4,5)21(19)12-18(14)22-16(3)24-13-15(2)25(22)6;1-13-12-21-15(3)19(22(13)4)18-11-16-7-5-9-23-10-6-8-17(14(18)2)20(16)23;1-12-9-15-7-5-6-8-16(15)10-17(12)18-14(3)19-11-13(2)20(18)4;1-11-9-14(18(4)5)7-8-15(11)16-13(3)17-10-12(2)19(16)6;1-10-9-14(19-6)7-8-15(10)16-12(3)17-11(2)13(4)18(16)5;1-10-7-8-15(11(2)9-10)16-13(4)17-12(3)14(5)18(16)6;1-10-8-6-7-9-14(10)15-12(3)16-11(2)13(4)17(15)5/h5-19H,1-4H3;5-18H,1-4H3;7-13H,1-6H3;11-12H,5-10H2,1-4H3;5-11H,1-4H3;7-10H,1-6H3;7-9H,1-6H3;7-9H,1-6H3;6-9H,1-5H3/q9*+1
• InChIKey: UFFWEZAKMSEOMQ-UHFFFAOYSA-N
• XLogP: 35.77
• TPSA: 169.88 Ų
• H-Bond Acceptors: 13
• Rotatable Bonds: 14
• Heavy Atoms: 205
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2715.81
LogP ≤ 5	35.77
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	13

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethylphenyl)-1,3,5,6-tetramethylpyrazin-1-ium;2-(4-methoxy-2-methylphenyl)-1,3,5,6-tetramethylpyrazin-1-ium;3-methyl-N,N-diphenyl-4-(1,3,6-trimethylpyrazin-1-ium-2-yl)aniline;6-methyl-7-(1,3,6-trimethylpyrazin-1-ium-2-yl)-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8-triene;1,2,3,5-tetramethyl-6-(2-methylphenyl)pyrazin-1-ium;1,3,6-trimethyl-2-(3-methylnaphthalen-2-yl)pyrazin-1-ium;1,3,6-trimethyl-2-(3'-methyl-9,9'-spirobi[fluorene]-2'-yl)pyrazin-1-ium;1,3,6-trimethyl-2-(3,9,9-trimethylfluoren-2-yl)pyrazin-1-ium;N,N,3-trimethyl-4-(1,3,6-trimethylpyrazin-1-ium-2-yl)aniline?

The IUPAC name of 2-(2,4-dimethylphenyl)-1,3,5,6-tetramethylpyrazin-1-ium;2-(4-methoxy-2-methylphenyl)-1,3,5,6-tetramethylpyrazin-1-ium;3-methyl-N,N-diphenyl-4-(1,3,6-trimethylpyrazin-1-ium-2-yl)aniline;6-methyl-7-(1,3,6-trimethylpyrazin-1-ium-2-yl)-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8-triene;1,2,3,5-tetramethyl-6-(2-methylphenyl)pyrazin-1-ium;1,3,6-trimethyl-2-(3-methylnaphthalen-2-yl)pyrazin-1-ium;1,3,6-trimethyl-2-(3'-methyl-9,9'-spirobi[fluorene]-2'-yl)pyrazin-1-ium;1,3,6-trimethyl-2-(3,9,9-trimethylfluoren-2-yl)pyrazin-1-ium;N,N,3-trimethyl-4-(1,3,6-trimethylpyrazin-1-ium-2-yl)aniline (CID 160553797) is 2-(2,4-dimethylphenyl)-1,3,5,6-tetramethylpyrazin-1-ium;2-(4-methoxy-2-methylphenyl)-1,3,5,6-tetramethylpyrazin-1-ium;3-methyl-N,N-diphenyl-4-(1,3,6-trimethylpyrazin-1-ium-2-yl)aniline;6-methyl-7-(1,3,6-trimethylpyrazin-1-ium-2-yl)-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8-triene;1,2,3,5-tetramethyl-6-(2-methylphenyl)pyrazin-1-ium;1,3,6-trimethyl-2-(3-methylnaphthalen-2-yl)pyrazin-1-ium;1,3,6-trimethyl-2-(3'-methyl-9,9'-spirobi[fluorene]-2'-yl)pyrazin-1-ium;1,3,6-trimethyl-2-(3,9,9-trimethylfluoren-2-yl)pyrazin-1-ium;N,N,3-trimethyl-4-(1,3,6-trimethylpyrazin-1-ium-2-yl)aniline.

What is the SMILES notation for 2-(2,4-dimethylphenyl)-1,3,5,6-tetramethylpyrazin-1-ium;2-(4-methoxy-2-methylphenyl)-1,3,5,6-tetramethylpyrazin-1-ium;3-methyl-N,N-diphenyl-4-(1,3,6-trimethylpyrazin-1-ium-2-yl)aniline;6-methyl-7-(1,3,6-trimethylpyrazin-1-ium-2-yl)-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8-triene;1,2,3,5-tetramethyl-6-(2-methylphenyl)pyrazin-1-ium;1,3,6-trimethyl-2-(3-methylnaphthalen-2-yl)pyrazin-1-ium;1,3,6-trimethyl-2-(3'-methyl-9,9'-spirobi[fluorene]-2'-yl)pyrazin-1-ium;1,3,6-trimethyl-2-(3,9,9-trimethylfluoren-2-yl)pyrazin-1-ium;N,N,3-trimethyl-4-(1,3,6-trimethylpyrazin-1-ium-2-yl)aniline?

The canonical SMILES for 2-(2,4-dimethylphenyl)-1,3,5,6-tetramethylpyrazin-1-ium;2-(4-methoxy-2-methylphenyl)-1,3,5,6-tetramethylpyrazin-1-ium;3-methyl-N,N-diphenyl-4-(1,3,6-trimethylpyrazin-1-ium-2-yl)aniline;6-methyl-7-(1,3,6-trimethylpyrazin-1-ium-2-yl)-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8-triene;1,2,3,5-tetramethyl-6-(2-methylphenyl)pyrazin-1-ium;1,3,6-trimethyl-2-(3-methylnaphthalen-2-yl)pyrazin-1-ium;1,3,6-trimethyl-2-(3'-methyl-9,9'-spirobi[fluorene]-2'-yl)pyrazin-1-ium;1,3,6-trimethyl-2-(3,9,9-trimethylfluoren-2-yl)pyrazin-1-ium;N,N,3-trimethyl-4-(1,3,6-trimethylpyrazin-1-ium-2-yl)aniline is COc1ccc(-c2c(C)nc(C)c(C)[n+]2C)c(C)c1.Cc1cc(N(C)C)ccc1-c1c(C)ncc(C)[n+]1C.Cc1cc(N(c2ccccc2)c2ccccc2)ccc1-c1c(C)ncc(C)[n+]1C.Cc1cc2c(cc1-c1c(C)ncc(C)[n+]1C)C(C)(C)c1ccccc1-2.Cc1cc2c(cc1-c1c(C)ncc(C)[n+]1C)C1(c3ccccc3-c3ccccc31)c1ccccc1-2.Cc1cc2ccccc2cc1-c1c(C)ncc(C)[n+]1C.Cc1ccc(-c2c(C)nc(C)c(C)[n+]2C)c(C)c1.Cc1ccccc1-c1c(C)nc(C)c(C)[n+]1C.Cc1ncc(C)[n+](C)c1-c1cc2c3c(c1C)CCCN3CCC2.

What is the InChIKey of 2-(2,4-dimethylphenyl)-1,3,5,6-tetramethylpyrazin-1-ium;2-(4-methoxy-2-methylphenyl)-1,3,5,6-tetramethylpyrazin-1-ium;3-methyl-N,N-diphenyl-4-(1,3,6-trimethylpyrazin-1-ium-2-yl)aniline;6-methyl-7-(1,3,6-trimethylpyrazin-1-ium-2-yl)-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8-triene;1,2,3,5-tetramethyl-6-(2-methylphenyl)pyrazin-1-ium;1,3,6-trimethyl-2-(3-methylnaphthalen-2-yl)pyrazin-1-ium;1,3,6-trimethyl-2-(3'-methyl-9,9'-spirobi[fluorene]-2'-yl)pyrazin-1-ium;1,3,6-trimethyl-2-(3,9,9-trimethylfluoren-2-yl)pyrazin-1-ium;N,N,3-trimethyl-4-(1,3,6-trimethylpyrazin-1-ium-2-yl)aniline?

The InChIKey is UFFWEZAKMSEOMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H27N2.C26H26N3.C23H25N2.C20H26N3.C18H19N2.C16H22N3.C16H21N2O.C16H21N2.C15H19N2/c1-20-17-27-25-13-7-10-16-30(25)33(28-14-8-5-11-23(28)24-12-6-9-15-29(24)33)31(27)18-26(20)32-22(3)34-19-21(2)35(32)4;1-19-17-24(15-16-25(19)26-21(3)27-18-20(2)28(26)4)29(22-11-7-5-8-12-22)23-13-9-6-10-14-23;1-14-11-19-17-9-7-8-10-20(17)23(4,5)21(19)12-18(14)22-16(3)24-13-15(2)25(22)6;1-13-12-21-15(3)19(22(13)4)18-11-16-7-5-9-23-10-6-8-17(14(18)2)20(16)23;1-12-9-15-7-5-6-8-16(15)10-17(12)18-14(3)19-11-13(2)20(18)4;1-11-9-14(18(4)5)7-8-15(11)16-13(3)17-10-12(2)19(16)6;1-10-9-14(19-6)7-8-15(10)16-12(3)17-11(2)13(4)18(16)5;1-10-7-8-15(11(2)9-10)16-13(4)17-12(3)14(5)18(16)6;1-10-8-6-7-9-14(10)15-12(3)16-11(2)13(4)17(15)5/h5-19H,1-4H3;5-18H,1-4H3;7-13H,1-6H3;11-12H,5-10H2,1-4H3;5-11H,1-4H3;7-10H,1-6H3;7-9H,1-6H3;7-9H,1-6H3;6-9H,1-5H3/q9*+1.

What are the key properties of 2-(2,4-dimethylphenyl)-1,3,5,6-tetramethylpyrazin-1-ium;2-(4-methoxy-2-methylphenyl)-1,3,5,6-tetramethylpyrazin-1-ium;3-methyl-N,N-diphenyl-4-(1,3,6-trimethylpyrazin-1-ium-2-yl)aniline;6-methyl-7-(1,3,6-trimethylpyrazin-1-ium-2-yl)-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8-triene;1,2,3,5-tetramethyl-6-(2-methylphenyl)pyrazin-1-ium;1,3,6-trimethyl-2-(3-methylnaphthalen-2-yl)pyrazin-1-ium;1,3,6-trimethyl-2-(3'-methyl-9,9'-spirobi[fluorene]-2'-yl)pyrazin-1-ium;1,3,6-trimethyl-2-(3,9,9-trimethylfluoren-2-yl)pyrazin-1-ium;N,N,3-trimethyl-4-(1,3,6-trimethylpyrazin-1-ium-2-yl)aniline?

2-(2,4-dimethylphenyl)-1,3,5,6-tetramethylpyrazin-1-ium;2-(4-methoxy-2-methylphenyl)-1,3,5,6-tetramethylpyrazin-1-ium;3-methyl-N,N-diphenyl-4-(1,3,6-trimethylpyrazin-1-ium-2-yl)aniline;6-methyl-7-(1,3,6-trimethylpyrazin-1-ium-2-yl)-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8-triene;1,2,3,5-tetramethyl-6-(2-methylphenyl)pyrazin-1-ium;1,3,6-trimethyl-2-(3-methylnaphthalen-2-yl)pyrazin-1-ium;1,3,6-trimethyl-2-(3'-methyl-9,9'-spirobi[fluorene]-2'-yl)pyrazin-1-ium;1,3,6-trimethyl-2-(3,9,9-trimethylfluoren-2-yl)pyrazin-1-ium;N,N,3-trimethyl-4-(1,3,6-trimethylpyrazin-1-ium-2-yl)aniline has a molecular weight of 2715.81 g/mol, XLogP of 35.77, 14 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(2,4-dimethylphenyl)-1,3,5,6-tetramethylpyrazin-1-ium;2-(4-methoxy-2-methylphenyl)-1,3,5,6-tetramethylpyrazin-1-ium;3-methyl-N,N-diphenyl-4-(1,3,6-trimethylpyrazin-1-ium-2-yl)aniline;6-methyl-7-(1,3,6-trimethylpyrazin-1-ium-2-yl)-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8-triene;1,2,3,5-tetramethyl-6-(2-methylphenyl)pyrazin-1-ium;1,3,6-trimethyl-2-(3-methylnaphthalen-2-yl)pyrazin-1-ium;1,3,6-trimethyl-2-(3'-methyl-9,9'-spirobi[fluorene]-2'-yl)pyrazin-1-ium;1,3,6-trimethyl-2-(3,9,9-trimethylfluoren-2-yl)pyrazin-1-ium;N,N,3-trimethyl-4-(1,3,6-trimethylpyrazin-1-ium-2-yl)aniline is sourced from PubChem (CID 160553797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).