1-methyl-2-(3-methyldibenzofuran-4-yl)imidazo[1,2-a]pyridin-4-ium;2-methyl-3-(3-methyldibenzofuran-4-yl)imidazo[1,5-a]pyridin-2-ium;1-methyl-7-(3-methyldibenzofuran-4-yl)pyrrolo[1,2-b]pyridazin-1-ium;2-methyl-1-(2-methylphenyl)pyrazino[1,2-a]indol-2-ium;2-methyl-3-(2-methylphenyl)pyrazino[1,2-a]indol-2-ium

C101H85N10O3+5 — CID 157267288

About 1-methyl-2-(3-methyldibenzofuran-4-yl)imidazo[1,2-a]pyridin-4-ium;2-methyl-3-(3-methyldibenzofuran-4-yl)imidazo[1,5-a]pyridin-2-ium;1-methyl-7-(3-methyldibenzofuran-4-yl)pyrrolo[1,2-b]pyridazin-1-ium;2-methyl-1-(2-methylphenyl)pyrazino[1,2-a]indol-2-ium;2-methyl-3-(2-methylphenyl)pyrazino[1,2-a]indol-2-ium

1-methyl-2-(3-methyldibenzofuran-4-yl)imidazo[1,2-a]pyridin-4-ium;2-methyl-3-(3-methyldibenzofuran-4-yl)imidazo[1,5-a]pyridin-2-ium;1-methyl-7-(3-methyldibenzofuran-4-yl)pyrrolo[1,2-b]pyridazin-1-ium;2-methyl-1-(2-methylphenyl)pyrazino[1,2-a]indol-2-ium;2-methyl-3-(2-methylphenyl)pyrazino[1,2-a]indol-2-ium (PubChem CID 157267288) has the molecular formula C101H85N10O3+5 and a molecular weight of 1486.86 g/mol. Its IUPAC name is 1-methyl-2-(3-methyldibenzofuran-4-yl)imidazo[1,2-a]pyridin-4-ium;2-methyl-3-(3-methyldibenzofuran-4-yl)imidazo[1,5-a]pyridin-2-ium;1-methyl-7-(3-methyldibenzofuran-4-yl)pyrrolo[1,2-b]pyridazin-1-ium;2-methyl-1-(2-methylphenyl)pyrazino[1,2-a]indol-2-ium;2-methyl-3-(2-methylphenyl)pyrazino[1,2-a]indol-2-ium.

Molecular Properties

• Compound Name: 1-methyl-2-(3-methyldibenzofuran-4-yl)imidazo[1,2-a]pyridin-4-ium;2-methyl-3-(3-methyldibenzofuran-4-yl)imidazo[1,5-a]pyridin-2-ium;1-methyl-7-(3-methyldibenzofuran-4-yl)pyrrolo[1,2-b]pyridazin-1-ium;2-methyl-1-(2-methylphenyl)pyrazino[1,2-a]indol-2-ium;2-methyl-3-(2-methylphenyl)pyrazino[1,2-a]indol-2-ium
• PubChem CID: 157267288
• Molecular Formula: C101H85N10O3+5
• Molecular Weight: 1486.86 g/mol
• Exact Mass: 1485.68
• IUPAC Name: 1-methyl-2-(3-methyldibenzofuran-4-yl)imidazo[1,2-a]pyridin-4-ium;2-methyl-3-(3-methyldibenzofuran-4-yl)imidazo[1,5-a]pyridin-2-ium;1-methyl-7-(3-methyldibenzofuran-4-yl)pyrrolo[1,2-b]pyridazin-1-ium;2-methyl-1-(2-methylphenyl)pyrazino[1,2-a]indol-2-ium;2-methyl-3-(2-methylphenyl)pyrazino[1,2-a]indol-2-ium
• SMILES: Cc1ccc2c(oc3ccccc32)c1-c1c[n+]2ccccc2n1C.Cc1ccc2c(oc3ccccc32)c1-c1ccc2ccc[n+](C)n12.Cc1ccc2c(oc3ccccc32)c1-c1n2ccccc2c[n+]1C.Cc1ccccc1-c1c2cc3ccccc3n2cc[n+]1C.Cc1ccccc1-c1cn2c(cc3ccccc32)c[n+]1C
• InChI: InChI=1S/3C21H17N2O.2C19H17N2/c1-14-10-11-17-16-8-3-4-9-18(16)24-20(17)19(14)21-22(2)13-15-7-5-6-12-23(15)21;1-14-9-11-17-16-7-3-4-8-19(16)24-21(17)20(14)18-12-10-15-6-5-13-22(2)23(15)18;1-14-10-11-16-15-7-3-4-8-18(15)24-21(16)20(14)17-13-23-12-6-5-9-19(23)22(17)2;1-14-7-3-5-9-17(14)19-13-21-16(12-20(19)2)11-15-8-4-6-10-18(15)21;1-14-7-3-5-9-16(14)19-18-13-15-8-4-6-10-17(15)21(18)12-11-20(19)2/h3*3-13H,1-2H3;2*3-13H,1-2H3/q5*+1
• InChIKey: LSMKSWULADNRIJ-UHFFFAOYSA-N
• XLogP: 21.70
• TPSA: 81.61 Ų
• H-Bond Acceptors: 8
• Rotatable Bonds: 5
• Heavy Atoms: 114
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1486.86
LogP ≤ 5	21.70
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	8

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-(3-methyldibenzofuran-4-yl)imidazo[1,2-a]pyridin-4-ium;2-methyl-3-(3-methyldibenzofuran-4-yl)imidazo[1,5-a]pyridin-2-ium;1-methyl-7-(3-methyldibenzofuran-4-yl)pyrrolo[1,2-b]pyridazin-1-ium;2-methyl-1-(2-methylphenyl)pyrazino[1,2-a]indol-2-ium;2-methyl-3-(2-methylphenyl)pyrazino[1,2-a]indol-2-ium?

The IUPAC name of 1-methyl-2-(3-methyldibenzofuran-4-yl)imidazo[1,2-a]pyridin-4-ium;2-methyl-3-(3-methyldibenzofuran-4-yl)imidazo[1,5-a]pyridin-2-ium;1-methyl-7-(3-methyldibenzofuran-4-yl)pyrrolo[1,2-b]pyridazin-1-ium;2-methyl-1-(2-methylphenyl)pyrazino[1,2-a]indol-2-ium;2-methyl-3-(2-methylphenyl)pyrazino[1,2-a]indol-2-ium (CID 157267288) is 1-methyl-2-(3-methyldibenzofuran-4-yl)imidazo[1,2-a]pyridin-4-ium;2-methyl-3-(3-methyldibenzofuran-4-yl)imidazo[1,5-a]pyridin-2-ium;1-methyl-7-(3-methyldibenzofuran-4-yl)pyrrolo[1,2-b]pyridazin-1-ium;2-methyl-1-(2-methylphenyl)pyrazino[1,2-a]indol-2-ium;2-methyl-3-(2-methylphenyl)pyrazino[1,2-a]indol-2-ium.

What is the SMILES notation for 1-methyl-2-(3-methyldibenzofuran-4-yl)imidazo[1,2-a]pyridin-4-ium;2-methyl-3-(3-methyldibenzofuran-4-yl)imidazo[1,5-a]pyridin-2-ium;1-methyl-7-(3-methyldibenzofuran-4-yl)pyrrolo[1,2-b]pyridazin-1-ium;2-methyl-1-(2-methylphenyl)pyrazino[1,2-a]indol-2-ium;2-methyl-3-(2-methylphenyl)pyrazino[1,2-a]indol-2-ium?

The canonical SMILES for 1-methyl-2-(3-methyldibenzofuran-4-yl)imidazo[1,2-a]pyridin-4-ium;2-methyl-3-(3-methyldibenzofuran-4-yl)imidazo[1,5-a]pyridin-2-ium;1-methyl-7-(3-methyldibenzofuran-4-yl)pyrrolo[1,2-b]pyridazin-1-ium;2-methyl-1-(2-methylphenyl)pyrazino[1,2-a]indol-2-ium;2-methyl-3-(2-methylphenyl)pyrazino[1,2-a]indol-2-ium is Cc1ccc2c(oc3ccccc32)c1-c1c[n+]2ccccc2n1C.Cc1ccc2c(oc3ccccc32)c1-c1ccc2ccc[n+](C)n12.Cc1ccc2c(oc3ccccc32)c1-c1n2ccccc2c[n+]1C.Cc1ccccc1-c1c2cc3ccccc3n2cc[n+]1C.Cc1ccccc1-c1cn2c(cc3ccccc32)c[n+]1C.

What is the InChIKey of 1-methyl-2-(3-methyldibenzofuran-4-yl)imidazo[1,2-a]pyridin-4-ium;2-methyl-3-(3-methyldibenzofuran-4-yl)imidazo[1,5-a]pyridin-2-ium;1-methyl-7-(3-methyldibenzofuran-4-yl)pyrrolo[1,2-b]pyridazin-1-ium;2-methyl-1-(2-methylphenyl)pyrazino[1,2-a]indol-2-ium;2-methyl-3-(2-methylphenyl)pyrazino[1,2-a]indol-2-ium?

The InChIKey is LSMKSWULADNRIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/3C21H17N2O.2C19H17N2/c1-14-10-11-17-16-8-3-4-9-18(16)24-20(17)19(14)21-22(2)13-15-7-5-6-12-23(15)21;1-14-9-11-17-16-7-3-4-8-19(16)24-21(17)20(14)18-12-10-15-6-5-13-22(2)23(15)18;1-14-10-11-16-15-7-3-4-8-18(15)24-21(16)20(14)17-13-23-12-6-5-9-19(23)22(17)2;1-14-7-3-5-9-17(14)19-13-21-16(12-20(19)2)11-15-8-4-6-10-18(15)21;1-14-7-3-5-9-16(14)19-18-13-15-8-4-6-10-17(15)21(18)12-11-20(19)2/h3*3-13H,1-2H3;2*3-13H,1-2H3/q5*+1.

What are the key properties of 1-methyl-2-(3-methyldibenzofuran-4-yl)imidazo[1,2-a]pyridin-4-ium;2-methyl-3-(3-methyldibenzofuran-4-yl)imidazo[1,5-a]pyridin-2-ium;1-methyl-7-(3-methyldibenzofuran-4-yl)pyrrolo[1,2-b]pyridazin-1-ium;2-methyl-1-(2-methylphenyl)pyrazino[1,2-a]indol-2-ium;2-methyl-3-(2-methylphenyl)pyrazino[1,2-a]indol-2-ium?

1-methyl-2-(3-methyldibenzofuran-4-yl)imidazo[1,2-a]pyridin-4-ium;2-methyl-3-(3-methyldibenzofuran-4-yl)imidazo[1,5-a]pyridin-2-ium;1-methyl-7-(3-methyldibenzofuran-4-yl)pyrrolo[1,2-b]pyridazin-1-ium;2-methyl-1-(2-methylphenyl)pyrazino[1,2-a]indol-2-ium;2-methyl-3-(2-methylphenyl)pyrazino[1,2-a]indol-2-ium has a molecular weight of 1486.86 g/mol, XLogP of 21.70, 5 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 1-methyl-2-(3-methyldibenzofuran-4-yl)imidazo[1,2-a]pyridin-4-ium;2-methyl-3-(3-methyldibenzofuran-4-yl)imidazo[1,5-a]pyridin-2-ium;1-methyl-7-(3-methyldibenzofuran-4-yl)pyrrolo[1,2-b]pyridazin-1-ium;2-methyl-1-(2-methylphenyl)pyrazino[1,2-a]indol-2-ium;2-methyl-3-(2-methylphenyl)pyrazino[1,2-a]indol-2-ium is sourced from PubChem (CID 157267288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).