2-(2,4-dimethylbenzene-6-id-1-yl)-5-phenylpyridine;5-(2,6-dimethylphenyl)-2-(2,3,4,5-tetradeuteriobenzene-6-id-1-yl)pyridine;tetrakis(iridium);5-(2-methoxyphenyl)-2-phenylpyridine;2-phenyl-4-[2-(trifluoromethyl)phenyl]pyridine

C74H57F3Ir4N4O-4 — CID 161237974

About 2-(2,4-dimethylbenzene-6-id-1-yl)-5-phenylpyridine;5-(2,6-dimethylphenyl)-2-(2,3,4,5-tetradeuteriobenzene-6-id-1-yl)pyridine;tetrakis(iridium);5-(2-methoxyphenyl)-2-phenylpyridine;2-phenyl-4-[2-(trifluoromethyl)phenyl]pyridine

2-(2,4-dimethylbenzene-6-id-1-yl)-5-phenylpyridine;5-(2,6-dimethylphenyl)-2-(2,3,4,5-tetradeuteriobenzene-6-id-1-yl)pyridine;tetrakis(iridium);5-(2-methoxyphenyl)-2-phenylpyridine;2-phenyl-4-[2-(trifluoromethyl)phenyl]pyridine (PubChem CID 161237974) has the molecular formula C74H57F3Ir4N4O-4 and a molecular weight of 1848.18 g/mol. Its IUPAC name is 2-(2,4-dimethylbenzene-6-id-1-yl)-5-phenylpyridine;5-(2,6-dimethylphenyl)-2-(2,3,4,5-tetradeuteriobenzene-6-id-1-yl)pyridine;tetrakis(iridium);5-(2-methoxyphenyl)-2-phenylpyridine;2-phenyl-4-[2-(trifluoromethyl)phenyl]pyridine.

Molecular Properties

• Compound Name: 2-(2,4-dimethylbenzene-6-id-1-yl)-5-phenylpyridine;5-(2,6-dimethylphenyl)-2-(2,3,4,5-tetradeuteriobenzene-6-id-1-yl)pyridine;tetrakis(iridium);5-(2-methoxyphenyl)-2-phenylpyridine;2-phenyl-4-[2-(trifluoromethyl)phenyl]pyridine
• PubChem CID: 161237974
• Molecular Formula: C74H57F3Ir4N4O-4
• Molecular Weight: 1848.18 g/mol
• Exact Mass: 1850.33
• IUPAC Name: 2-(2,4-dimethylbenzene-6-id-1-yl)-5-phenylpyridine;5-(2,6-dimethylphenyl)-2-(2,3,4,5-tetradeuteriobenzene-6-id-1-yl)pyridine;tetrakis(iridium);5-(2-methoxyphenyl)-2-phenylpyridine;2-phenyl-4-[2-(trifluoromethyl)phenyl]pyridine
• SMILES: COc1ccccc1-c1ccc(-c2[c-]cccc2)nc1.Cc1c[c-]c(-c2ccc(-c3ccccc3)cn2)c(C)c1.FC(F)(F)c1ccccc1-c1ccnc(-c2[c-]cccc2)c1.[2H]c1[c-]c(-c2ccc(-c3c(C)cccc3C)cn2)c([2H])c([2H])c1[2H].[Ir].[Ir].[Ir].[Ir]
• InChI: InChI=1S/2C19H16N.C18H11F3N.C18H14NO.4Ir/c1-14-7-6-8-15(2)19(14)17-11-12-18(20-13-17)16-9-4-3-5-10-16;1-14-8-10-18(15(2)12-14)19-11-9-17(13-20-19)16-6-4-3-5-7-16;19-18(20,21)16-9-5-4-8-15(16)14-10-11-22-17(12-14)13-6-2-1-3-7-13;1-20-18-10-6-5-9-16(18)15-11-12-17(19-13-15)14-7-3-2-4-8-14;;;;/h2*3-9,11-13H,1-2H3;1-6,8-12H;2-7,9-13H,1H3;;;;/q4*-1;;;;/i3D,4D,5D,9D
• InChIKey: GLUWBKPPNNWGEI-XZUOEFHZSA-N
• XLogP: 19.11
• TPSA: 60.79 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 9
• Heavy Atoms: 86
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1848.18
LogP ≤ 5	19.11
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethylbenzene-6-id-1-yl)-5-phenylpyridine;5-(2,6-dimethylphenyl)-2-(2,3,4,5-tetradeuteriobenzene-6-id-1-yl)pyridine;tetrakis(iridium);5-(2-methoxyphenyl)-2-phenylpyridine;2-phenyl-4-[2-(trifluoromethyl)phenyl]pyridine?

The IUPAC name of 2-(2,4-dimethylbenzene-6-id-1-yl)-5-phenylpyridine;5-(2,6-dimethylphenyl)-2-(2,3,4,5-tetradeuteriobenzene-6-id-1-yl)pyridine;tetrakis(iridium);5-(2-methoxyphenyl)-2-phenylpyridine;2-phenyl-4-[2-(trifluoromethyl)phenyl]pyridine (CID 161237974) is 2-(2,4-dimethylbenzene-6-id-1-yl)-5-phenylpyridine;5-(2,6-dimethylphenyl)-2-(2,3,4,5-tetradeuteriobenzene-6-id-1-yl)pyridine;tetrakis(iridium);5-(2-methoxyphenyl)-2-phenylpyridine;2-phenyl-4-[2-(trifluoromethyl)phenyl]pyridine.

What is the SMILES notation for 2-(2,4-dimethylbenzene-6-id-1-yl)-5-phenylpyridine;5-(2,6-dimethylphenyl)-2-(2,3,4,5-tetradeuteriobenzene-6-id-1-yl)pyridine;tetrakis(iridium);5-(2-methoxyphenyl)-2-phenylpyridine;2-phenyl-4-[2-(trifluoromethyl)phenyl]pyridine?

The canonical SMILES for 2-(2,4-dimethylbenzene-6-id-1-yl)-5-phenylpyridine;5-(2,6-dimethylphenyl)-2-(2,3,4,5-tetradeuteriobenzene-6-id-1-yl)pyridine;tetrakis(iridium);5-(2-methoxyphenyl)-2-phenylpyridine;2-phenyl-4-[2-(trifluoromethyl)phenyl]pyridine is COc1ccccc1-c1ccc(-c2[c-]cccc2)nc1.Cc1c[c-]c(-c2ccc(-c3ccccc3)cn2)c(C)c1.FC(F)(F)c1ccccc1-c1ccnc(-c2[c-]cccc2)c1.[2H]c1[c-]c(-c2ccc(-c3c(C)cccc3C)cn2)c([2H])c([2H])c1[2H].[Ir].[Ir].[Ir].[Ir].

What is the InChIKey of 2-(2,4-dimethylbenzene-6-id-1-yl)-5-phenylpyridine;5-(2,6-dimethylphenyl)-2-(2,3,4,5-tetradeuteriobenzene-6-id-1-yl)pyridine;tetrakis(iridium);5-(2-methoxyphenyl)-2-phenylpyridine;2-phenyl-4-[2-(trifluoromethyl)phenyl]pyridine?

The InChIKey is GLUWBKPPNNWGEI-XZUOEFHZSA-N. The full InChI is InChI=1S/2C19H16N.C18H11F3N.C18H14NO.4Ir/c1-14-7-6-8-15(2)19(14)17-11-12-18(20-13-17)16-9-4-3-5-10-16;1-14-8-10-18(15(2)12-14)19-11-9-17(13-20-19)16-6-4-3-5-7-16;19-18(20,21)16-9-5-4-8-15(16)14-10-11-22-17(12-14)13-6-2-1-3-7-13;1-20-18-10-6-5-9-16(18)15-11-12-17(19-13-15)14-7-3-2-4-8-14;;;;/h2*3-9,11-13H,1-2H3;1-6,8-12H;2-7,9-13H,1H3;;;;/q4*-1;;;;/i3D,4D,5D,9D;;;;;;;.

What are the key properties of 2-(2,4-dimethylbenzene-6-id-1-yl)-5-phenylpyridine;5-(2,6-dimethylphenyl)-2-(2,3,4,5-tetradeuteriobenzene-6-id-1-yl)pyridine;tetrakis(iridium);5-(2-methoxyphenyl)-2-phenylpyridine;2-phenyl-4-[2-(trifluoromethyl)phenyl]pyridine?

2-(2,4-dimethylbenzene-6-id-1-yl)-5-phenylpyridine;5-(2,6-dimethylphenyl)-2-(2,3,4,5-tetradeuteriobenzene-6-id-1-yl)pyridine;tetrakis(iridium);5-(2-methoxyphenyl)-2-phenylpyridine;2-phenyl-4-[2-(trifluoromethyl)phenyl]pyridine has a molecular weight of 1848.18 g/mol, XLogP of 19.11, 9 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(2,4-dimethylbenzene-6-id-1-yl)-5-phenylpyridine;5-(2,6-dimethylphenyl)-2-(2,3,4,5-tetradeuteriobenzene-6-id-1-yl)pyridine;tetrakis(iridium);5-(2-methoxyphenyl)-2-phenylpyridine;2-phenyl-4-[2-(trifluoromethyl)phenyl]pyridine is sourced from PubChem (CID 161237974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).