2-cyclohexylimidazo[1,5-a]indol-2-ium-1-one;2-(4-methoxyphenyl)-5,6-dihydropyrrolo[1,2-c]imidazol-2-ium-3-one;2-(2-methylphenyl)pyrrolo[1,2-c]imidazol-2-ium-3-one;bis(2-methylpyrrolo[1,2-c]imidazol-2-ium-3-one);2-methylpyrrolo[2,1-c][1,2,4]triazol-2-ium-3-one;5-phenylimidazo[1,5-b]pyrazol-5-ium-6-one;2-phenylimidazo[5,1-c][1,2,4]triazol-2-ium-3-one;2-phenylpyrrolo[2,1-c][1,2,4]triazol-2-ium-3-one;2-[4-(trifluoromethyl)phenyl]pyrrolo[1,2-c]imidazol-2-ium-3-one

C107H92F3N25O11+10 — CID 160935133

About 2-cyclohexylimidazo[1,5-a]indol-2-ium-1-one;2-(4-methoxyphenyl)-5,6-dihydropyrrolo[1,2-c]imidazol-2-ium-3-one;2-(2-methylphenyl)pyrrolo[1,2-c]imidazol-2-ium-3-one;bis(2-methylpyrrolo[1,2-c]imidazol-2-ium-3-one);2-methylpyrrolo[2,1-c][1,2,4]triazol-2-ium-3-one;5-phenylimidazo[1,5-b]pyrazol-5-ium-6-one;2-phenylimidazo[5,1-c][1,2,4]triazol-2-ium-3-one;2-phenylpyrrolo[2,1-c][1,2,4]triazol-2-ium-3-one;2-[4-(trifluoromethyl)phenyl]pyrrolo[1,2-c]imidazol-2-ium-3-one

2-cyclohexylimidazo[1,5-a]indol-2-ium-1-one;2-(4-methoxyphenyl)-5,6-dihydropyrrolo[1,2-c]imidazol-2-ium-3-one;2-(2-methylphenyl)pyrrolo[1,2-c]imidazol-2-ium-3-one;bis(2-methylpyrrolo[1,2-c]imidazol-2-ium-3-one);2-methylpyrrolo[2,1-c][1,2,4]triazol-2-ium-3-one;5-phenylimidazo[1,5-b]pyrazol-5-ium-6-one;2-phenylimidazo[5,1-c][1,2,4]triazol-2-ium-3-one;2-phenylpyrrolo[2,1-c][1,2,4]triazol-2-ium-3-one;2-[4-(trifluoromethyl)phenyl]pyrrolo[1,2-c]imidazol-2-ium-3-one (PubChem CID 160935133) has the molecular formula C107H92F3N25O11+10 and a molecular weight of 1961.07 g/mol. Its IUPAC name is 2-cyclohexylimidazo[1,5-a]indol-2-ium-1-one;2-(4-methoxyphenyl)-5,6-dihydropyrrolo[1,2-c]imidazol-2-ium-3-one;2-(2-methylphenyl)pyrrolo[1,2-c]imidazol-2-ium-3-one;bis(2-methylpyrrolo[1,2-c]imidazol-2-ium-3-one);2-methylpyrrolo[2,1-c][1,2,4]triazol-2-ium-3-one;5-phenylimidazo[1,5-b]pyrazol-5-ium-6-one;2-phenylimidazo[5,1-c][1,2,4]triazol-2-ium-3-one;2-phenylpyrrolo[2,1-c][1,2,4]triazol-2-ium-3-one;2-[4-(trifluoromethyl)phenyl]pyrrolo[1,2-c]imidazol-2-ium-3-one.

Molecular Properties

• Compound Name: 2-cyclohexylimidazo[1,5-a]indol-2-ium-1-one;2-(4-methoxyphenyl)-5,6-dihydropyrrolo[1,2-c]imidazol-2-ium-3-one;2-(2-methylphenyl)pyrrolo[1,2-c]imidazol-2-ium-3-one;bis(2-methylpyrrolo[1,2-c]imidazol-2-ium-3-one);2-methylpyrrolo[2,1-c][1,2,4]triazol-2-ium-3-one;5-phenylimidazo[1,5-b]pyrazol-5-ium-6-one;2-phenylimidazo[5,1-c][1,2,4]triazol-2-ium-3-one;2-phenylpyrrolo[2,1-c][1,2,4]triazol-2-ium-3-one;2-[4-(trifluoromethyl)phenyl]pyrrolo[1,2-c]imidazol-2-ium-3-one
• PubChem CID: 160935133
• Molecular Formula: C107H92F3N25O11+10
• Molecular Weight: 1961.07 g/mol
• Exact Mass: 1959.73
• IUPAC Name: 2-cyclohexylimidazo[1,5-a]indol-2-ium-1-one;2-(4-methoxyphenyl)-5,6-dihydropyrrolo[1,2-c]imidazol-2-ium-3-one;2-(2-methylphenyl)pyrrolo[1,2-c]imidazol-2-ium-3-one;bis(2-methylpyrrolo[1,2-c]imidazol-2-ium-3-one);2-methylpyrrolo[2,1-c][1,2,4]triazol-2-ium-3-one;5-phenylimidazo[1,5-b]pyrazol-5-ium-6-one;2-phenylimidazo[5,1-c][1,2,4]triazol-2-ium-3-one;2-phenylpyrrolo[2,1-c][1,2,4]triazol-2-ium-3-one;2-[4-(trifluoromethyl)phenyl]pyrrolo[1,2-c]imidazol-2-ium-3-one
• SMILES: COc1ccc([N+]2=CC3=CCCN3C2=O)cc1.C[N+]1=Cc2cccn2C1=O.C[N+]1=Cc2cccn2C1=O.C[N+]1=Nc2cccn2C1=O.Cc1ccccc1[N+]1=Cc2cccn2C1=O.O=C1n2c(cc3ccccc32)C=[N+]1C1CCCCC1.O=C1n2cccc2C=[N+]1c1ccc(C(F)(F)F)cc1.O=C1n2cccc2N=[N+]1c1ccccc1.O=C1n2cncc2N=[N+]1c1ccccc1.O=C1n2nccc2C=[N+]1c1ccccc1
• InChI: InChI=1S/C16H17N2O.C13H8F3N2O.C13H13N2O2.C13H11N2O.2C11H8N3O.C10H7N4O.2C7H7N2O.C6H6N3O/c19-16-17(13-7-2-1-3-8-13)11-14-10-12-6-4-5-9-15(12)18(14)16;14-13(15,16)9-3-5-10(6-4-9)18-8-11-2-1-7-17(11)12(18)19;1-17-12-6-4-10(5-7-12)15-9-11-3-2-8-14(11)13(15)16;1-10-5-2-3-7-12(10)15-9-11-6-4-8-14(11)13(15)16;15-11-13-8-4-7-10(13)12-14(11)9-5-2-1-3-6-9;15-11-13(9-4-2-1-3-5-9)8-10-6-7-12-14(10)11;15-10-13-7-11-6-9(13)12-14(10)8-4-2-1-3-5-8;2*1-8-5-6-3-2-4-9(6)7(8)10;1-8-6(10)9-4-2-3-5(9)7-8/h4-6,9-11,13H,1-3,7-8H2;1-8H;3-7,9H,2,8H2,1H3;2-9H,1H3;2*1-8H;1-7H;2*2-5H,1H3;2-4H,1H3/q10*+1
• InChIKey: MYGIEQKJLKIDMC-UHFFFAOYSA-N
• XLogP: 20.39
• TPSA: 320.50 Ų
• H-Bond Acceptors: 25
• Rotatable Bonds: 8
• Heavy Atoms: 146
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1961.07
LogP ≤ 5	20.39
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	25

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexylimidazo[1,5-a]indol-2-ium-1-one;2-(4-methoxyphenyl)-5,6-dihydropyrrolo[1,2-c]imidazol-2-ium-3-one;2-(2-methylphenyl)pyrrolo[1,2-c]imidazol-2-ium-3-one;bis(2-methylpyrrolo[1,2-c]imidazol-2-ium-3-one);2-methylpyrrolo[2,1-c][1,2,4]triazol-2-ium-3-one;5-phenylimidazo[1,5-b]pyrazol-5-ium-6-one;2-phenylimidazo[5,1-c][1,2,4]triazol-2-ium-3-one;2-phenylpyrrolo[2,1-c][1,2,4]triazol-2-ium-3-one;2-[4-(trifluoromethyl)phenyl]pyrrolo[1,2-c]imidazol-2-ium-3-one?

The IUPAC name of 2-cyclohexylimidazo[1,5-a]indol-2-ium-1-one;2-(4-methoxyphenyl)-5,6-dihydropyrrolo[1,2-c]imidazol-2-ium-3-one;2-(2-methylphenyl)pyrrolo[1,2-c]imidazol-2-ium-3-one;bis(2-methylpyrrolo[1,2-c]imidazol-2-ium-3-one);2-methylpyrrolo[2,1-c][1,2,4]triazol-2-ium-3-one;5-phenylimidazo[1,5-b]pyrazol-5-ium-6-one;2-phenylimidazo[5,1-c][1,2,4]triazol-2-ium-3-one;2-phenylpyrrolo[2,1-c][1,2,4]triazol-2-ium-3-one;2-[4-(trifluoromethyl)phenyl]pyrrolo[1,2-c]imidazol-2-ium-3-one (CID 160935133) is 2-cyclohexylimidazo[1,5-a]indol-2-ium-1-one;2-(4-methoxyphenyl)-5,6-dihydropyrrolo[1,2-c]imidazol-2-ium-3-one;2-(2-methylphenyl)pyrrolo[1,2-c]imidazol-2-ium-3-one;bis(2-methylpyrrolo[1,2-c]imidazol-2-ium-3-one);2-methylpyrrolo[2,1-c][1,2,4]triazol-2-ium-3-one;5-phenylimidazo[1,5-b]pyrazol-5-ium-6-one;2-phenylimidazo[5,1-c][1,2,4]triazol-2-ium-3-one;2-phenylpyrrolo[2,1-c][1,2,4]triazol-2-ium-3-one;2-[4-(trifluoromethyl)phenyl]pyrrolo[1,2-c]imidazol-2-ium-3-one.

What is the SMILES notation for 2-cyclohexylimidazo[1,5-a]indol-2-ium-1-one;2-(4-methoxyphenyl)-5,6-dihydropyrrolo[1,2-c]imidazol-2-ium-3-one;2-(2-methylphenyl)pyrrolo[1,2-c]imidazol-2-ium-3-one;bis(2-methylpyrrolo[1,2-c]imidazol-2-ium-3-one);2-methylpyrrolo[2,1-c][1,2,4]triazol-2-ium-3-one;5-phenylimidazo[1,5-b]pyrazol-5-ium-6-one;2-phenylimidazo[5,1-c][1,2,4]triazol-2-ium-3-one;2-phenylpyrrolo[2,1-c][1,2,4]triazol-2-ium-3-one;2-[4-(trifluoromethyl)phenyl]pyrrolo[1,2-c]imidazol-2-ium-3-one?

The canonical SMILES for 2-cyclohexylimidazo[1,5-a]indol-2-ium-1-one;2-(4-methoxyphenyl)-5,6-dihydropyrrolo[1,2-c]imidazol-2-ium-3-one;2-(2-methylphenyl)pyrrolo[1,2-c]imidazol-2-ium-3-one;bis(2-methylpyrrolo[1,2-c]imidazol-2-ium-3-one);2-methylpyrrolo[2,1-c][1,2,4]triazol-2-ium-3-one;5-phenylimidazo[1,5-b]pyrazol-5-ium-6-one;2-phenylimidazo[5,1-c][1,2,4]triazol-2-ium-3-one;2-phenylpyrrolo[2,1-c][1,2,4]triazol-2-ium-3-one;2-[4-(trifluoromethyl)phenyl]pyrrolo[1,2-c]imidazol-2-ium-3-one is COc1ccc([N+]2=CC3=CCCN3C2=O)cc1.C[N+]1=Cc2cccn2C1=O.C[N+]1=Cc2cccn2C1=O.C[N+]1=Nc2cccn2C1=O.Cc1ccccc1[N+]1=Cc2cccn2C1=O.O=C1n2c(cc3ccccc32)C=[N+]1C1CCCCC1.O=C1n2cccc2C=[N+]1c1ccc(C(F)(F)F)cc1.O=C1n2cccc2N=[N+]1c1ccccc1.O=C1n2cncc2N=[N+]1c1ccccc1.O=C1n2nccc2C=[N+]1c1ccccc1.

What is the InChIKey of 2-cyclohexylimidazo[1,5-a]indol-2-ium-1-one;2-(4-methoxyphenyl)-5,6-dihydropyrrolo[1,2-c]imidazol-2-ium-3-one;2-(2-methylphenyl)pyrrolo[1,2-c]imidazol-2-ium-3-one;bis(2-methylpyrrolo[1,2-c]imidazol-2-ium-3-one);2-methylpyrrolo[2,1-c][1,2,4]triazol-2-ium-3-one;5-phenylimidazo[1,5-b]pyrazol-5-ium-6-one;2-phenylimidazo[5,1-c][1,2,4]triazol-2-ium-3-one;2-phenylpyrrolo[2,1-c][1,2,4]triazol-2-ium-3-one;2-[4-(trifluoromethyl)phenyl]pyrrolo[1,2-c]imidazol-2-ium-3-one?

The InChIKey is MYGIEQKJLKIDMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N2O.C13H8F3N2O.C13H13N2O2.C13H11N2O.2C11H8N3O.C10H7N4O.2C7H7N2O.C6H6N3O/c19-16-17(13-7-2-1-3-8-13)11-14-10-12-6-4-5-9-15(12)18(14)16;14-13(15,16)9-3-5-10(6-4-9)18-8-11-2-1-7-17(11)12(18)19;1-17-12-6-4-10(5-7-12)15-9-11-3-2-8-14(11)13(15)16;1-10-5-2-3-7-12(10)15-9-11-6-4-8-14(11)13(15)16;15-11-13-8-4-7-10(13)12-14(11)9-5-2-1-3-6-9;15-11-13(9-4-2-1-3-5-9)8-10-6-7-12-14(10)11;15-10-13-7-11-6-9(13)12-14(10)8-4-2-1-3-5-8;2*1-8-5-6-3-2-4-9(6)7(8)10;1-8-6(10)9-4-2-3-5(9)7-8/h4-6,9-11,13H,1-3,7-8H2;1-8H;3-7,9H,2,8H2,1H3;2-9H,1H3;2*1-8H;1-7H;2*2-5H,1H3;2-4H,1H3/q10*+1.

What are the key properties of 2-cyclohexylimidazo[1,5-a]indol-2-ium-1-one;2-(4-methoxyphenyl)-5,6-dihydropyrrolo[1,2-c]imidazol-2-ium-3-one;2-(2-methylphenyl)pyrrolo[1,2-c]imidazol-2-ium-3-one;bis(2-methylpyrrolo[1,2-c]imidazol-2-ium-3-one);2-methylpyrrolo[2,1-c][1,2,4]triazol-2-ium-3-one;5-phenylimidazo[1,5-b]pyrazol-5-ium-6-one;2-phenylimidazo[5,1-c][1,2,4]triazol-2-ium-3-one;2-phenylpyrrolo[2,1-c][1,2,4]triazol-2-ium-3-one;2-[4-(trifluoromethyl)phenyl]pyrrolo[1,2-c]imidazol-2-ium-3-one?

2-cyclohexylimidazo[1,5-a]indol-2-ium-1-one;2-(4-methoxyphenyl)-5,6-dihydropyrrolo[1,2-c]imidazol-2-ium-3-one;2-(2-methylphenyl)pyrrolo[1,2-c]imidazol-2-ium-3-one;bis(2-methylpyrrolo[1,2-c]imidazol-2-ium-3-one);2-methylpyrrolo[2,1-c][1,2,4]triazol-2-ium-3-one;5-phenylimidazo[1,5-b]pyrazol-5-ium-6-one;2-phenylimidazo[5,1-c][1,2,4]triazol-2-ium-3-one;2-phenylpyrrolo[2,1-c][1,2,4]triazol-2-ium-3-one;2-[4-(trifluoromethyl)phenyl]pyrrolo[1,2-c]imidazol-2-ium-3-one has a molecular weight of 1961.07 g/mol, XLogP of 20.39, 8 rotatable bonds, 0 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for 2-cyclohexylimidazo[1,5-a]indol-2-ium-1-one;2-(4-methoxyphenyl)-5,6-dihydropyrrolo[1,2-c]imidazol-2-ium-3-one;2-(2-methylphenyl)pyrrolo[1,2-c]imidazol-2-ium-3-one;bis(2-methylpyrrolo[1,2-c]imidazol-2-ium-3-one);2-methylpyrrolo[2,1-c][1,2,4]triazol-2-ium-3-one;5-phenylimidazo[1,5-b]pyrazol-5-ium-6-one;2-phenylimidazo[5,1-c][1,2,4]triazol-2-ium-3-one;2-phenylpyrrolo[2,1-c][1,2,4]triazol-2-ium-3-one;2-[4-(trifluoromethyl)phenyl]pyrrolo[1,2-c]imidazol-2-ium-3-one is sourced from PubChem (CID 160935133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).