1,10-dimethylbenzo[h]quinolin-1-ium;1-methyl-2-(3-methyl-1-benzothiophen-2-yl)pyridin-1-ium;1-methyl-2-(3-methyl-1-benzothiophen-2-yl)-5-(trifluoromethyl)pyridin-1-ium;1-methyl-2-(3-methylnaphthalen-2-yl)pyridin-1-ium;1-methyl-2-(2-methylphenyl)pyridin-1-ium;1-methyl-2-(2-methylphenyl)-5-(trifluoromethyl)pyridin-1-ium;1-methyl-2-(3-methyl-5,6,7,8-tetrahydronaphthalen-2-yl)pyridin-1-ium;1-methyl-2-(3-methylthiophen-2-yl)pyridin-1-ium;1-methyl-2-[2-methyl-5-(trifluoromethyl)phenyl]pyridin-1-ium;2-methyl-3-phenylisoquinolin-2-ium

C148H143F9N10S3+10 — CID 159539756

About 1,10-dimethylbenzo[h]quinolin-1-ium;1-methyl-2-(3-methyl-1-benzothiophen-2-yl)pyridin-1-ium;1-methyl-2-(3-methyl-1-benzothiophen-2-yl)-5-(trifluoromethyl)pyridin-1-ium;1-methyl-2-(3-methylnaphthalen-2-yl)pyridin-1-ium;1-methyl-2-(2-methylphenyl)pyridin-1-ium;1-methyl-2-(2-methylphenyl)-5-(trifluoromethyl)pyridin-1-ium;1-methyl-2-(3-methyl-5,6,7,8-tetrahydronaphthalen-2-yl)pyridin-1-ium;1-methyl-2-(3-methylthiophen-2-yl)pyridin-1-ium;1-methyl-2-[2-methyl-5-(trifluoromethyl)phenyl]pyridin-1-ium;2-methyl-3-phenylisoquinolin-2-ium

1,10-dimethylbenzo[h]quinolin-1-ium;1-methyl-2-(3-methyl-1-benzothiophen-2-yl)pyridin-1-ium;1-methyl-2-(3-methyl-1-benzothiophen-2-yl)-5-(trifluoromethyl)pyridin-1-ium;1-methyl-2-(3-methylnaphthalen-2-yl)pyridin-1-ium;1-methyl-2-(2-methylphenyl)pyridin-1-ium;1-methyl-2-(2-methylphenyl)-5-(trifluoromethyl)pyridin-1-ium;1-methyl-2-(3-methyl-5,6,7,8-tetrahydronaphthalen-2-yl)pyridin-1-ium;1-methyl-2-(3-methylthiophen-2-yl)pyridin-1-ium;1-methyl-2-[2-methyl-5-(trifluoromethyl)phenyl]pyridin-1-ium;2-methyl-3-phenylisoquinolin-2-ium (PubChem CID 159539756) has the molecular formula C148H143F9N10S3+10 and a molecular weight of 2329.02 g/mol. Its IUPAC name is 1,10-dimethylbenzo[h]quinolin-1-ium;1-methyl-2-(3-methyl-1-benzothiophen-2-yl)pyridin-1-ium;1-methyl-2-(3-methyl-1-benzothiophen-2-yl)-5-(trifluoromethyl)pyridin-1-ium;1-methyl-2-(3-methylnaphthalen-2-yl)pyridin-1-ium;1-methyl-2-(2-methylphenyl)pyridin-1-ium;1-methyl-2-(2-methylphenyl)-5-(trifluoromethyl)pyridin-1-ium;1-methyl-2-(3-methyl-5,6,7,8-tetrahydronaphthalen-2-yl)pyridin-1-ium;1-methyl-2-(3-methylthiophen-2-yl)pyridin-1-ium;1-methyl-2-[2-methyl-5-(trifluoromethyl)phenyl]pyridin-1-ium;2-methyl-3-phenylisoquinolin-2-ium.

Molecular Properties

• Compound Name: 1,10-dimethylbenzo[h]quinolin-1-ium;1-methyl-2-(3-methyl-1-benzothiophen-2-yl)pyridin-1-ium;1-methyl-2-(3-methyl-1-benzothiophen-2-yl)-5-(trifluoromethyl)pyridin-1-ium;1-methyl-2-(3-methylnaphthalen-2-yl)pyridin-1-ium;1-methyl-2-(2-methylphenyl)pyridin-1-ium;1-methyl-2-(2-methylphenyl)-5-(trifluoromethyl)pyridin-1-ium;1-methyl-2-(3-methyl-5,6,7,8-tetrahydronaphthalen-2-yl)pyridin-1-ium;1-methyl-2-(3-methylthiophen-2-yl)pyridin-1-ium;1-methyl-2-[2-methyl-5-(trifluoromethyl)phenyl]pyridin-1-ium;2-methyl-3-phenylisoquinolin-2-ium
• PubChem CID: 159539756
• Molecular Formula: C148H143F9N10S3+10
• Molecular Weight: 2329.02 g/mol
• Exact Mass: 2327.05
• IUPAC Name: 1,10-dimethylbenzo[h]quinolin-1-ium;1-methyl-2-(3-methyl-1-benzothiophen-2-yl)pyridin-1-ium;1-methyl-2-(3-methyl-1-benzothiophen-2-yl)-5-(trifluoromethyl)pyridin-1-ium;1-methyl-2-(3-methylnaphthalen-2-yl)pyridin-1-ium;1-methyl-2-(2-methylphenyl)pyridin-1-ium;1-methyl-2-(2-methylphenyl)-5-(trifluoromethyl)pyridin-1-ium;1-methyl-2-(3-methyl-5,6,7,8-tetrahydronaphthalen-2-yl)pyridin-1-ium;1-methyl-2-(3-methylthiophen-2-yl)pyridin-1-ium;1-methyl-2-[2-methyl-5-(trifluoromethyl)phenyl]pyridin-1-ium;2-methyl-3-phenylisoquinolin-2-ium
• SMILES: C[n+]1cc2ccccc2cc1-c1ccccc1.Cc1c(-c2ccc(C(F)(F)F)c[n+]2C)sc2ccccc12.Cc1c(-c2cccc[n+]2C)sc2ccccc12.Cc1cc2c(cc1-c1cccc[n+]1C)CCCC2.Cc1cc2ccccc2cc1-c1cccc[n+]1C.Cc1ccc(C(F)(F)F)cc1-c1cccc[n+]1C.Cc1cccc2ccc3ccc[n+](C)c3c12.Cc1ccccc1-c1ccc(C(F)(F)F)c[n+]1C.Cc1ccccc1-c1cccc[n+]1C.Cc1ccsc1-c1cccc[n+]1C
• InChI: InChI=1S/C17H20N.C17H16N.C16H13F3NS.C16H14N.C15H14NS.C15H14N.2C14H13F3N.C13H14N.C11H12NS/c2*1-13-11-14-7-3-4-8-15(14)12-16(13)17-9-5-6-10-18(17)2;1-10-12-5-3-4-6-14(12)21-15(10)13-8-7-11(9-20(13)2)16(17,18)19;1-17-12-15-10-6-5-9-14(15)11-16(17)13-7-3-2-4-8-13;1-11-12-7-3-4-9-14(12)17-15(11)13-8-5-6-10-16(13)2;1-11-5-3-6-12-8-9-13-7-4-10-16(2)15(13)14(11)12;1-10-6-7-11(14(15,16)17)9-12(10)13-5-3-4-8-18(13)2;1-10-5-3-4-6-12(10)13-8-7-11(9-18(13)2)14(15,16)17;1-11-7-3-4-8-12(11)13-9-5-6-10-14(13)2;1-9-6-8-13-11(9)10-5-3-4-7-12(10)2/h5-6,9-12H,3-4,7-8H2,1-2H3;3-12H,1-2H3;3-9H,1-2H3;2-12H,1H3;3-10H,1-2H3;3-10H,1-2H3;2*3-9H,1-2H3;3-10H,1-2H3;3-8H,1-2H3/q10*+1
• InChIKey: JQWUGWCJPXITBF-UHFFFAOYSA-N
• XLogP: 33.93
• TPSA: 38.80 Ų
• H-Bond Acceptors: 3
• Rotatable Bonds: 9
• Heavy Atoms: 170
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2329.02
LogP ≤ 5	33.93
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	3

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1,10-dimethylbenzo[h]quinolin-1-ium;1-methyl-2-(3-methyl-1-benzothiophen-2-yl)pyridin-1-ium;1-methyl-2-(3-methyl-1-benzothiophen-2-yl)-5-(trifluoromethyl)pyridin-1-ium;1-methyl-2-(3-methylnaphthalen-2-yl)pyridin-1-ium;1-methyl-2-(2-methylphenyl)pyridin-1-ium;1-methyl-2-(2-methylphenyl)-5-(trifluoromethyl)pyridin-1-ium;1-methyl-2-(3-methyl-5,6,7,8-tetrahydronaphthalen-2-yl)pyridin-1-ium;1-methyl-2-(3-methylthiophen-2-yl)pyridin-1-ium;1-methyl-2-[2-methyl-5-(trifluoromethyl)phenyl]pyridin-1-ium;2-methyl-3-phenylisoquinolin-2-ium?

The IUPAC name of 1,10-dimethylbenzo[h]quinolin-1-ium;1-methyl-2-(3-methyl-1-benzothiophen-2-yl)pyridin-1-ium;1-methyl-2-(3-methyl-1-benzothiophen-2-yl)-5-(trifluoromethyl)pyridin-1-ium;1-methyl-2-(3-methylnaphthalen-2-yl)pyridin-1-ium;1-methyl-2-(2-methylphenyl)pyridin-1-ium;1-methyl-2-(2-methylphenyl)-5-(trifluoromethyl)pyridin-1-ium;1-methyl-2-(3-methyl-5,6,7,8-tetrahydronaphthalen-2-yl)pyridin-1-ium;1-methyl-2-(3-methylthiophen-2-yl)pyridin-1-ium;1-methyl-2-[2-methyl-5-(trifluoromethyl)phenyl]pyridin-1-ium;2-methyl-3-phenylisoquinolin-2-ium (CID 159539756) is 1,10-dimethylbenzo[h]quinolin-1-ium;1-methyl-2-(3-methyl-1-benzothiophen-2-yl)pyridin-1-ium;1-methyl-2-(3-methyl-1-benzothiophen-2-yl)-5-(trifluoromethyl)pyridin-1-ium;1-methyl-2-(3-methylnaphthalen-2-yl)pyridin-1-ium;1-methyl-2-(2-methylphenyl)pyridin-1-ium;1-methyl-2-(2-methylphenyl)-5-(trifluoromethyl)pyridin-1-ium;1-methyl-2-(3-methyl-5,6,7,8-tetrahydronaphthalen-2-yl)pyridin-1-ium;1-methyl-2-(3-methylthiophen-2-yl)pyridin-1-ium;1-methyl-2-[2-methyl-5-(trifluoromethyl)phenyl]pyridin-1-ium;2-methyl-3-phenylisoquinolin-2-ium.

What is the SMILES notation for 1,10-dimethylbenzo[h]quinolin-1-ium;1-methyl-2-(3-methyl-1-benzothiophen-2-yl)pyridin-1-ium;1-methyl-2-(3-methyl-1-benzothiophen-2-yl)-5-(trifluoromethyl)pyridin-1-ium;1-methyl-2-(3-methylnaphthalen-2-yl)pyridin-1-ium;1-methyl-2-(2-methylphenyl)pyridin-1-ium;1-methyl-2-(2-methylphenyl)-5-(trifluoromethyl)pyridin-1-ium;1-methyl-2-(3-methyl-5,6,7,8-tetrahydronaphthalen-2-yl)pyridin-1-ium;1-methyl-2-(3-methylthiophen-2-yl)pyridin-1-ium;1-methyl-2-[2-methyl-5-(trifluoromethyl)phenyl]pyridin-1-ium;2-methyl-3-phenylisoquinolin-2-ium?

The canonical SMILES for 1,10-dimethylbenzo[h]quinolin-1-ium;1-methyl-2-(3-methyl-1-benzothiophen-2-yl)pyridin-1-ium;1-methyl-2-(3-methyl-1-benzothiophen-2-yl)-5-(trifluoromethyl)pyridin-1-ium;1-methyl-2-(3-methylnaphthalen-2-yl)pyridin-1-ium;1-methyl-2-(2-methylphenyl)pyridin-1-ium;1-methyl-2-(2-methylphenyl)-5-(trifluoromethyl)pyridin-1-ium;1-methyl-2-(3-methyl-5,6,7,8-tetrahydronaphthalen-2-yl)pyridin-1-ium;1-methyl-2-(3-methylthiophen-2-yl)pyridin-1-ium;1-methyl-2-[2-methyl-5-(trifluoromethyl)phenyl]pyridin-1-ium;2-methyl-3-phenylisoquinolin-2-ium is C[n+]1cc2ccccc2cc1-c1ccccc1.Cc1c(-c2ccc(C(F)(F)F)c[n+]2C)sc2ccccc12.Cc1c(-c2cccc[n+]2C)sc2ccccc12.Cc1cc2c(cc1-c1cccc[n+]1C)CCCC2.Cc1cc2ccccc2cc1-c1cccc[n+]1C.Cc1ccc(C(F)(F)F)cc1-c1cccc[n+]1C.Cc1cccc2ccc3ccc[n+](C)c3c12.Cc1ccccc1-c1ccc(C(F)(F)F)c[n+]1C.Cc1ccccc1-c1cccc[n+]1C.Cc1ccsc1-c1cccc[n+]1C.

What is the InChIKey of 1,10-dimethylbenzo[h]quinolin-1-ium;1-methyl-2-(3-methyl-1-benzothiophen-2-yl)pyridin-1-ium;1-methyl-2-(3-methyl-1-benzothiophen-2-yl)-5-(trifluoromethyl)pyridin-1-ium;1-methyl-2-(3-methylnaphthalen-2-yl)pyridin-1-ium;1-methyl-2-(2-methylphenyl)pyridin-1-ium;1-methyl-2-(2-methylphenyl)-5-(trifluoromethyl)pyridin-1-ium;1-methyl-2-(3-methyl-5,6,7,8-tetrahydronaphthalen-2-yl)pyridin-1-ium;1-methyl-2-(3-methylthiophen-2-yl)pyridin-1-ium;1-methyl-2-[2-methyl-5-(trifluoromethyl)phenyl]pyridin-1-ium;2-methyl-3-phenylisoquinolin-2-ium?

The InChIKey is JQWUGWCJPXITBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N.C17H16N.C16H13F3NS.C16H14N.C15H14NS.C15H14N.2C14H13F3N.C13H14N.C11H12NS/c2*1-13-11-14-7-3-4-8-15(14)12-16(13)17-9-5-6-10-18(17)2;1-10-12-5-3-4-6-14(12)21-15(10)13-8-7-11(9-20(13)2)16(17,18)19;1-17-12-15-10-6-5-9-14(15)11-16(17)13-7-3-2-4-8-13;1-11-12-7-3-4-9-14(12)17-15(11)13-8-5-6-10-16(13)2;1-11-5-3-6-12-8-9-13-7-4-10-16(2)15(13)14(11)12;1-10-6-7-11(14(15,16)17)9-12(10)13-5-3-4-8-18(13)2;1-10-5-3-4-6-12(10)13-8-7-11(9-18(13)2)14(15,16)17;1-11-7-3-4-8-12(11)13-9-5-6-10-14(13)2;1-9-6-8-13-11(9)10-5-3-4-7-12(10)2/h5-6,9-12H,3-4,7-8H2,1-2H3;3-12H,1-2H3;3-9H,1-2H3;2-12H,1H3;3-10H,1-2H3;3-10H,1-2H3;2*3-9H,1-2H3;3-10H,1-2H3;3-8H,1-2H3/q10*+1.

What are the key properties of 1,10-dimethylbenzo[h]quinolin-1-ium;1-methyl-2-(3-methyl-1-benzothiophen-2-yl)pyridin-1-ium;1-methyl-2-(3-methyl-1-benzothiophen-2-yl)-5-(trifluoromethyl)pyridin-1-ium;1-methyl-2-(3-methylnaphthalen-2-yl)pyridin-1-ium;1-methyl-2-(2-methylphenyl)pyridin-1-ium;1-methyl-2-(2-methylphenyl)-5-(trifluoromethyl)pyridin-1-ium;1-methyl-2-(3-methyl-5,6,7,8-tetrahydronaphthalen-2-yl)pyridin-1-ium;1-methyl-2-(3-methylthiophen-2-yl)pyridin-1-ium;1-methyl-2-[2-methyl-5-(trifluoromethyl)phenyl]pyridin-1-ium;2-methyl-3-phenylisoquinolin-2-ium?

1,10-dimethylbenzo[h]quinolin-1-ium;1-methyl-2-(3-methyl-1-benzothiophen-2-yl)pyridin-1-ium;1-methyl-2-(3-methyl-1-benzothiophen-2-yl)-5-(trifluoromethyl)pyridin-1-ium;1-methyl-2-(3-methylnaphthalen-2-yl)pyridin-1-ium;1-methyl-2-(2-methylphenyl)pyridin-1-ium;1-methyl-2-(2-methylphenyl)-5-(trifluoromethyl)pyridin-1-ium;1-methyl-2-(3-methyl-5,6,7,8-tetrahydronaphthalen-2-yl)pyridin-1-ium;1-methyl-2-(3-methylthiophen-2-yl)pyridin-1-ium;1-methyl-2-[2-methyl-5-(trifluoromethyl)phenyl]pyridin-1-ium;2-methyl-3-phenylisoquinolin-2-ium has a molecular weight of 2329.02 g/mol, XLogP of 33.93, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 1,10-dimethylbenzo[h]quinolin-1-ium;1-methyl-2-(3-methyl-1-benzothiophen-2-yl)pyridin-1-ium;1-methyl-2-(3-methyl-1-benzothiophen-2-yl)-5-(trifluoromethyl)pyridin-1-ium;1-methyl-2-(3-methylnaphthalen-2-yl)pyridin-1-ium;1-methyl-2-(2-methylphenyl)pyridin-1-ium;1-methyl-2-(2-methylphenyl)-5-(trifluoromethyl)pyridin-1-ium;1-methyl-2-(3-methyl-5,6,7,8-tetrahydronaphthalen-2-yl)pyridin-1-ium;1-methyl-2-(3-methylthiophen-2-yl)pyridin-1-ium;1-methyl-2-[2-methyl-5-(trifluoromethyl)phenyl]pyridin-1-ium;2-methyl-3-phenylisoquinolin-2-ium is sourced from PubChem (CID 159539756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).