tetrakis(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-2-(4-methylbenzene-6-id-1-yl)-4-(2-methylpropyl)pyridine;5-methyl-2-(4-methylbenzene-6-id-1-yl)pyridine;5-methyl-2-phenylpyridine;tetrakis(2-[3-(2-phenylpropan-2-yl)benzene-6-id-1-yl]pyridine)

C139H134Ir4N8-8 — CID 163932657

About tetrakis(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-2-(4-methylbenzene-6-id-1-yl)-4-(2-methylpropyl)pyridine;5-methyl-2-(4-methylbenzene-6-id-1-yl)pyridine;5-methyl-2-phenylpyridine;tetrakis(2-[3-(2-phenylpropan-2-yl)benzene-6-id-1-yl]pyridine)

tetrakis(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-2-(4-methylbenzene-6-id-1-yl)-4-(2-methylpropyl)pyridine;5-methyl-2-(4-methylbenzene-6-id-1-yl)pyridine;5-methyl-2-phenylpyridine;tetrakis(2-[3-(2-phenylpropan-2-yl)benzene-6-id-1-yl]pyridine) (PubChem CID 163932657) has the molecular formula C139H134Ir4N8-8 and a molecular weight of 2685.52 g/mol. Its IUPAC name is tetrakis(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-2-(4-methylbenzene-6-id-1-yl)-4-(2-methylpropyl)pyridine;5-methyl-2-(4-methylbenzene-6-id-1-yl)pyridine;5-methyl-2-phenylpyridine;tetrakis(2-[3-(2-phenylpropan-2-yl)benzene-6-id-1-yl]pyridine).

Molecular Properties

• Compound Name: tetrakis(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-2-(4-methylbenzene-6-id-1-yl)-4-(2-methylpropyl)pyridine;5-methyl-2-(4-methylbenzene-6-id-1-yl)pyridine;5-methyl-2-phenylpyridine;tetrakis(2-[3-(2-phenylpropan-2-yl)benzene-6-id-1-yl]pyridine)
• PubChem CID: 163932657
• Molecular Formula: C139H134Ir4N8-8
• Molecular Weight: 2685.52 g/mol
• Exact Mass: 2686.93
• IUPAC Name: tetrakis(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-2-(4-methylbenzene-6-id-1-yl)-4-(2-methylpropyl)pyridine;5-methyl-2-(4-methylbenzene-6-id-1-yl)pyridine;5-methyl-2-phenylpyridine;tetrakis(2-[3-(2-phenylpropan-2-yl)benzene-6-id-1-yl]pyridine)
• SMILES: CC(C)(c1ccccc1)c1cc[c-]c(-c2ccccn2)c1.CC(C)(c1ccccc1)c1cc[c-]c(-c2ccccn2)c1.CC(C)(c1ccccc1)c1cc[c-]c(-c2ccccn2)c1.CC(C)(c1ccccc1)c1cc[c-]c(-c2ccccn2)c1.Cc1c[c-]c(-c2cc(C)c(CC(C)C)cn2)cc1.Cc1c[c-]c(-c2cc(CC(C)C)c(C)cn2)cc1.Cc1c[c-]c(-c2ccc(C)cn2)cc1.Cc1ccc(-c2[c-]cccc2)nc1.[Ir].[Ir].[Ir].[Ir]
• InChI: InChI=1S/4C20H18N.2C17H20N.C13H12N.C12H10N.4Ir/c4*1-20(2,17-10-4-3-5-11-17)18-12-8-9-16(15-18)19-13-6-7-14-21-19;1-12(2)9-16-10-17(18-11-14(16)4)15-7-5-13(3)6-8-15;1-12(2)9-16-11-18-17(10-14(16)4)15-7-5-13(3)6-8-15;1-10-3-6-12(7-4-10)13-8-5-11(2)9-14-13;1-10-7-8-12(13-9-10)11-5-3-2-4-6-11;;;;/h4*3-8,10-15H,1-2H3;2*5-7,10-12H,9H2,1-4H3;3-6,8-9H,1-2H3;2-5,7-9H,1H3;;;;/q8*-1
• InChIKey: IEFGVZPEKVWRJU-UHFFFAOYSA-N
• XLogP: 34.24
• TPSA: 103.12 Ų
• H-Bond Acceptors: 8
• Rotatable Bonds: 20
• Heavy Atoms: 151
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2685.52
LogP ≤ 5	34.24
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	8

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of tetrakis(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-2-(4-methylbenzene-6-id-1-yl)-4-(2-methylpropyl)pyridine;5-methyl-2-(4-methylbenzene-6-id-1-yl)pyridine;5-methyl-2-phenylpyridine;tetrakis(2-[3-(2-phenylpropan-2-yl)benzene-6-id-1-yl]pyridine)?

The IUPAC name of tetrakis(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-2-(4-methylbenzene-6-id-1-yl)-4-(2-methylpropyl)pyridine;5-methyl-2-(4-methylbenzene-6-id-1-yl)pyridine;5-methyl-2-phenylpyridine;tetrakis(2-[3-(2-phenylpropan-2-yl)benzene-6-id-1-yl]pyridine) (CID 163932657) is tetrakis(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-2-(4-methylbenzene-6-id-1-yl)-4-(2-methylpropyl)pyridine;5-methyl-2-(4-methylbenzene-6-id-1-yl)pyridine;5-methyl-2-phenylpyridine;tetrakis(2-[3-(2-phenylpropan-2-yl)benzene-6-id-1-yl]pyridine).

What is the SMILES notation for tetrakis(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-2-(4-methylbenzene-6-id-1-yl)-4-(2-methylpropyl)pyridine;5-methyl-2-(4-methylbenzene-6-id-1-yl)pyridine;5-methyl-2-phenylpyridine;tetrakis(2-[3-(2-phenylpropan-2-yl)benzene-6-id-1-yl]pyridine)?

The canonical SMILES for tetrakis(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-2-(4-methylbenzene-6-id-1-yl)-4-(2-methylpropyl)pyridine;5-methyl-2-(4-methylbenzene-6-id-1-yl)pyridine;5-methyl-2-phenylpyridine;tetrakis(2-[3-(2-phenylpropan-2-yl)benzene-6-id-1-yl]pyridine) is CC(C)(c1ccccc1)c1cc[c-]c(-c2ccccn2)c1.CC(C)(c1ccccc1)c1cc[c-]c(-c2ccccn2)c1.CC(C)(c1ccccc1)c1cc[c-]c(-c2ccccn2)c1.CC(C)(c1ccccc1)c1cc[c-]c(-c2ccccn2)c1.Cc1c[c-]c(-c2cc(C)c(CC(C)C)cn2)cc1.Cc1c[c-]c(-c2cc(CC(C)C)c(C)cn2)cc1.Cc1c[c-]c(-c2ccc(C)cn2)cc1.Cc1ccc(-c2[c-]cccc2)nc1.[Ir].[Ir].[Ir].[Ir].

What is the InChIKey of tetrakis(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-2-(4-methylbenzene-6-id-1-yl)-4-(2-methylpropyl)pyridine;5-methyl-2-(4-methylbenzene-6-id-1-yl)pyridine;5-methyl-2-phenylpyridine;tetrakis(2-[3-(2-phenylpropan-2-yl)benzene-6-id-1-yl]pyridine)?

The InChIKey is IEFGVZPEKVWRJU-UHFFFAOYSA-N. The full InChI is InChI=1S/4C20H18N.2C17H20N.C13H12N.C12H10N.4Ir/c4*1-20(2,17-10-4-3-5-11-17)18-12-8-9-16(15-18)19-13-6-7-14-21-19;1-12(2)9-16-10-17(18-11-14(16)4)15-7-5-13(3)6-8-15;1-12(2)9-16-11-18-17(10-14(16)4)15-7-5-13(3)6-8-15;1-10-3-6-12(7-4-10)13-8-5-11(2)9-14-13;1-10-7-8-12(13-9-10)11-5-3-2-4-6-11;;;;/h4*3-8,10-15H,1-2H3;2*5-7,10-12H,9H2,1-4H3;3-6,8-9H,1-2H3;2-5,7-9H,1H3;;;;/q8*-1;;;;.

What are the key properties of tetrakis(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-2-(4-methylbenzene-6-id-1-yl)-4-(2-methylpropyl)pyridine;5-methyl-2-(4-methylbenzene-6-id-1-yl)pyridine;5-methyl-2-phenylpyridine;tetrakis(2-[3-(2-phenylpropan-2-yl)benzene-6-id-1-yl]pyridine)?

tetrakis(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-2-(4-methylbenzene-6-id-1-yl)-4-(2-methylpropyl)pyridine;5-methyl-2-(4-methylbenzene-6-id-1-yl)pyridine;5-methyl-2-phenylpyridine;tetrakis(2-[3-(2-phenylpropan-2-yl)benzene-6-id-1-yl]pyridine) has a molecular weight of 2685.52 g/mol, XLogP of 34.24, 20 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for tetrakis(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-2-(4-methylbenzene-6-id-1-yl)-4-(2-methylpropyl)pyridine;5-methyl-2-(4-methylbenzene-6-id-1-yl)pyridine;5-methyl-2-phenylpyridine;tetrakis(2-[3-(2-phenylpropan-2-yl)benzene-6-id-1-yl]pyridine) is sourced from PubChem (CID 163932657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).