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-(2-methylphenyl)pyridazino[1,6-a]indol-1-ium

C99H85N10O2+5 — CID 157287804

About 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-(2-methylphenyl)pyridazino[1,6-a]indol-1-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-(2-methylphenyl)pyridazino[1,6-a]indol-1-ium (PubChem CID 157287804) has the molecular formula C99H85N10O2+5 and a molecular weight of 1446.84 g/mol. Its IUPAC name is 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-(2-methylphenyl)pyridazino[1,6-a]indol-1-ium.

Molecular Properties

• Compound Name: 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-(2-methylphenyl)pyridazino[1,6-a]indol-1-ium
• PubChem CID: 157287804
• Molecular Formula: C99H85N10O2+5
• Molecular Weight: 1446.84 g/mol
• Exact Mass: 1445.68
• IUPAC Name: 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-(2-methylphenyl)pyridazino[1,6-a]indol-1-ium
• SMILES: Cc1ccc2c(oc3ccccc32)c1-c1ccc2ccc[n+](C)n12.Cc1ccc2c(oc3ccccc32)c1-c1n2ccccc2c[n+]1C.Cc1ccccc1-c1c2cc3ccccc3n2cc[n+]1C.Cc1ccccc1-c1ccc2cc3ccccc3n2[n+]1C.Cc1ccccc1-c1cn2c(cc3ccccc32)c[n+]1C
• InChI: InChI=1S/2C21H17N2O.3C19H17N2/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;1-14-7-3-5-9-17(14)19-13-21-16(12-20(19)2)11-15-8-4-6-10-18(15)21;1-14-7-3-5-9-17(14)19-12-11-16-13-15-8-4-6-10-18(15)21(16)20(19)2;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/h2*3-13H,1-2H3;3*3-13H,1-2H3/q5*+1
• InChIKey: XJVRUGMPCMYMHZ-UHFFFAOYSA-N
• XLogP: 20.95
• TPSA: 67.73 Ų
• H-Bond Acceptors: 7
• Rotatable Bonds: 5
• Heavy Atoms: 111
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1446.84
LogP ≤ 5	20.95
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	7

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 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-(2-methylphenyl)pyridazino[1,6-a]indol-1-ium?

The IUPAC name of 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-(2-methylphenyl)pyridazino[1,6-a]indol-1-ium (CID 157287804) is 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-(2-methylphenyl)pyridazino[1,6-a]indol-1-ium.

What is the SMILES notation for 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-(2-methylphenyl)pyridazino[1,6-a]indol-1-ium?

The canonical SMILES for 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-(2-methylphenyl)pyridazino[1,6-a]indol-1-ium is Cc1ccc2c(oc3ccccc32)c1-c1ccc2ccc[n+](C)n12.Cc1ccc2c(oc3ccccc32)c1-c1n2ccccc2c[n+]1C.Cc1ccccc1-c1c2cc3ccccc3n2cc[n+]1C.Cc1ccccc1-c1ccc2cc3ccccc3n2[n+]1C.Cc1ccccc1-c1cn2c(cc3ccccc32)c[n+]1C.

What is the InChIKey of 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-(2-methylphenyl)pyridazino[1,6-a]indol-1-ium?

The InChIKey is XJVRUGMPCMYMHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C21H17N2O.3C19H17N2/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;1-14-7-3-5-9-17(14)19-13-21-16(12-20(19)2)11-15-8-4-6-10-18(15)21;1-14-7-3-5-9-17(14)19-12-11-16-13-15-8-4-6-10-18(15)21(16)20(19)2;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/h2*3-13H,1-2H3;3*3-13H,1-2H3/q5*+1.

What are the key properties of 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-(2-methylphenyl)pyridazino[1,6-a]indol-1-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-(2-methylphenyl)pyridazino[1,6-a]indol-1-ium has a molecular weight of 1446.84 g/mol, XLogP of 20.95, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 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-(2-methylphenyl)pyridazino[1,6-a]indol-1-ium is sourced from PubChem (CID 157287804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).