2-(2,6-dimethylphenyl)-3-[1-(2,2-dimethylpropyl)imidazol-2-yl]-4H-pyridin-4-ide;2-(2,6-dimethylphenyl)-3-(1-methylpyrazol-3-yl)-4H-pyridin-4-ide;6-(2,6-dimethylphenyl)-5-(1-methylpyrazol-3-yl)-4H-pyrimidin-4-ide;2-(2,6-dimethylphenyl)-3-pyrazol-1-yl-4H-pyridin-4-ide;tetrakis(iridium)

C70H69Ir4N13-4 — CID 159227829

About 2-(2,6-dimethylphenyl)-3-[1-(2,2-dimethylpropyl)imidazol-2-yl]-4H-pyridin-4-ide;2-(2,6-dimethylphenyl)-3-(1-methylpyrazol-3-yl)-4H-pyridin-4-ide;6-(2,6-dimethylphenyl)-5-(1-methylpyrazol-3-yl)-4H-pyrimidin-4-ide;2-(2,6-dimethylphenyl)-3-pyrazol-1-yl-4H-pyridin-4-ide;tetrakis(iridium)

2-(2,6-dimethylphenyl)-3-[1-(2,2-dimethylpropyl)imidazol-2-yl]-4H-pyridin-4-ide;2-(2,6-dimethylphenyl)-3-(1-methylpyrazol-3-yl)-4H-pyridin-4-ide;6-(2,6-dimethylphenyl)-5-(1-methylpyrazol-3-yl)-4H-pyrimidin-4-ide;2-(2,6-dimethylphenyl)-3-pyrazol-1-yl-4H-pyridin-4-ide;tetrakis(iridium) (PubChem CID 159227829) has the molecular formula C70H69Ir4N13-4 and a molecular weight of 1861.28 g/mol. Its IUPAC name is 2-(2,6-dimethylphenyl)-3-[1-(2,2-dimethylpropyl)imidazol-2-yl]-4H-pyridin-4-ide;2-(2,6-dimethylphenyl)-3-(1-methylpyrazol-3-yl)-4H-pyridin-4-ide;6-(2,6-dimethylphenyl)-5-(1-methylpyrazol-3-yl)-4H-pyrimidin-4-ide;2-(2,6-dimethylphenyl)-3-pyrazol-1-yl-4H-pyridin-4-ide;tetrakis(iridium).

Molecular Properties

• Compound Name: 2-(2,6-dimethylphenyl)-3-[1-(2,2-dimethylpropyl)imidazol-2-yl]-4H-pyridin-4-ide;2-(2,6-dimethylphenyl)-3-(1-methylpyrazol-3-yl)-4H-pyridin-4-ide;6-(2,6-dimethylphenyl)-5-(1-methylpyrazol-3-yl)-4H-pyrimidin-4-ide;2-(2,6-dimethylphenyl)-3-pyrazol-1-yl-4H-pyridin-4-ide;tetrakis(iridium)
• PubChem CID: 159227829
• Molecular Formula: C70H69Ir4N13-4
• Molecular Weight: 1861.28 g/mol
• Exact Mass: 1863.43
• IUPAC Name: 2-(2,6-dimethylphenyl)-3-[1-(2,2-dimethylpropyl)imidazol-2-yl]-4H-pyridin-4-ide;2-(2,6-dimethylphenyl)-3-(1-methylpyrazol-3-yl)-4H-pyridin-4-ide;6-(2,6-dimethylphenyl)-5-(1-methylpyrazol-3-yl)-4H-pyrimidin-4-ide;2-(2,6-dimethylphenyl)-3-pyrazol-1-yl-4H-pyridin-4-ide;tetrakis(iridium)
• SMILES: Cc1cccc(C)c1-c1ncc[c-]c1-c1ccn(C)n1.Cc1cccc(C)c1-c1ncc[c-]c1-c1nccn1CC(C)(C)C.Cc1cccc(C)c1-c1ncc[c-]c1-n1cccn1.Cc1cccc(C)c1-c1ncn[c-]c1-c1ccn(C)n1.[Ir].[Ir].[Ir].[Ir]
• InChI: InChI=1S/C21H24N3.C17H16N3.C16H15N4.C16H14N3.4Ir/c1-15-8-6-9-16(2)18(15)19-17(10-7-11-22-19)20-23-12-13-24(20)14-21(3,4)5;1-12-6-4-7-13(2)16(12)17-14(8-5-10-18-17)15-9-11-20(3)19-15;1-11-5-4-6-12(2)15(11)16-13(9-17-10-18-16)14-7-8-20(3)19-14;1-12-6-3-7-13(2)15(12)16-14(8-4-9-17-16)19-11-5-10-18-19;;;;/h6-9,11-13H,14H2,1-5H3;4-7,9-11H,1-3H3;4-8,10H,1-3H3;3-7,9-11H,1-2H3;;;;/q4*-1
• InChIKey: XCGMLKFZSIHLJH-UHFFFAOYSA-N
• XLogP: 14.94
• TPSA: 135.73 Ų
• H-Bond Acceptors: 13
• Rotatable Bonds: 9
• Heavy Atoms: 87
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1861.28
LogP ≤ 5	14.94
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	13

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethylphenyl)-3-[1-(2,2-dimethylpropyl)imidazol-2-yl]-4H-pyridin-4-ide;2-(2,6-dimethylphenyl)-3-(1-methylpyrazol-3-yl)-4H-pyridin-4-ide;6-(2,6-dimethylphenyl)-5-(1-methylpyrazol-3-yl)-4H-pyrimidin-4-ide;2-(2,6-dimethylphenyl)-3-pyrazol-1-yl-4H-pyridin-4-ide;tetrakis(iridium)?

The IUPAC name of 2-(2,6-dimethylphenyl)-3-[1-(2,2-dimethylpropyl)imidazol-2-yl]-4H-pyridin-4-ide;2-(2,6-dimethylphenyl)-3-(1-methylpyrazol-3-yl)-4H-pyridin-4-ide;6-(2,6-dimethylphenyl)-5-(1-methylpyrazol-3-yl)-4H-pyrimidin-4-ide;2-(2,6-dimethylphenyl)-3-pyrazol-1-yl-4H-pyridin-4-ide;tetrakis(iridium) (CID 159227829) is 2-(2,6-dimethylphenyl)-3-[1-(2,2-dimethylpropyl)imidazol-2-yl]-4H-pyridin-4-ide;2-(2,6-dimethylphenyl)-3-(1-methylpyrazol-3-yl)-4H-pyridin-4-ide;6-(2,6-dimethylphenyl)-5-(1-methylpyrazol-3-yl)-4H-pyrimidin-4-ide;2-(2,6-dimethylphenyl)-3-pyrazol-1-yl-4H-pyridin-4-ide;tetrakis(iridium).

What is the SMILES notation for 2-(2,6-dimethylphenyl)-3-[1-(2,2-dimethylpropyl)imidazol-2-yl]-4H-pyridin-4-ide;2-(2,6-dimethylphenyl)-3-(1-methylpyrazol-3-yl)-4H-pyridin-4-ide;6-(2,6-dimethylphenyl)-5-(1-methylpyrazol-3-yl)-4H-pyrimidin-4-ide;2-(2,6-dimethylphenyl)-3-pyrazol-1-yl-4H-pyridin-4-ide;tetrakis(iridium)?

The canonical SMILES for 2-(2,6-dimethylphenyl)-3-[1-(2,2-dimethylpropyl)imidazol-2-yl]-4H-pyridin-4-ide;2-(2,6-dimethylphenyl)-3-(1-methylpyrazol-3-yl)-4H-pyridin-4-ide;6-(2,6-dimethylphenyl)-5-(1-methylpyrazol-3-yl)-4H-pyrimidin-4-ide;2-(2,6-dimethylphenyl)-3-pyrazol-1-yl-4H-pyridin-4-ide;tetrakis(iridium) is Cc1cccc(C)c1-c1ncc[c-]c1-c1ccn(C)n1.Cc1cccc(C)c1-c1ncc[c-]c1-c1nccn1CC(C)(C)C.Cc1cccc(C)c1-c1ncc[c-]c1-n1cccn1.Cc1cccc(C)c1-c1ncn[c-]c1-c1ccn(C)n1.[Ir].[Ir].[Ir].[Ir].

What is the InChIKey of 2-(2,6-dimethylphenyl)-3-[1-(2,2-dimethylpropyl)imidazol-2-yl]-4H-pyridin-4-ide;2-(2,6-dimethylphenyl)-3-(1-methylpyrazol-3-yl)-4H-pyridin-4-ide;6-(2,6-dimethylphenyl)-5-(1-methylpyrazol-3-yl)-4H-pyrimidin-4-ide;2-(2,6-dimethylphenyl)-3-pyrazol-1-yl-4H-pyridin-4-ide;tetrakis(iridium)?

The InChIKey is XCGMLKFZSIHLJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N3.C17H16N3.C16H15N4.C16H14N3.4Ir/c1-15-8-6-9-16(2)18(15)19-17(10-7-11-22-19)20-23-12-13-24(20)14-21(3,4)5;1-12-6-4-7-13(2)16(12)17-14(8-5-10-18-17)15-9-11-20(3)19-15;1-11-5-4-6-12(2)15(11)16-13(9-17-10-18-16)14-7-8-20(3)19-14;1-12-6-3-7-13(2)15(12)16-14(8-4-9-17-16)19-11-5-10-18-19;;;;/h6-9,11-13H,14H2,1-5H3;4-7,9-11H,1-3H3;4-8,10H,1-3H3;3-7,9-11H,1-2H3;;;;/q4*-1;;;;.

What are the key properties of 2-(2,6-dimethylphenyl)-3-[1-(2,2-dimethylpropyl)imidazol-2-yl]-4H-pyridin-4-ide;2-(2,6-dimethylphenyl)-3-(1-methylpyrazol-3-yl)-4H-pyridin-4-ide;6-(2,6-dimethylphenyl)-5-(1-methylpyrazol-3-yl)-4H-pyrimidin-4-ide;2-(2,6-dimethylphenyl)-3-pyrazol-1-yl-4H-pyridin-4-ide;tetrakis(iridium)?

2-(2,6-dimethylphenyl)-3-[1-(2,2-dimethylpropyl)imidazol-2-yl]-4H-pyridin-4-ide;2-(2,6-dimethylphenyl)-3-(1-methylpyrazol-3-yl)-4H-pyridin-4-ide;6-(2,6-dimethylphenyl)-5-(1-methylpyrazol-3-yl)-4H-pyrimidin-4-ide;2-(2,6-dimethylphenyl)-3-pyrazol-1-yl-4H-pyridin-4-ide;tetrakis(iridium) has a molecular weight of 1861.28 g/mol, XLogP of 14.94, 9 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(2,6-dimethylphenyl)-3-[1-(2,2-dimethylpropyl)imidazol-2-yl]-4H-pyridin-4-ide;2-(2,6-dimethylphenyl)-3-(1-methylpyrazol-3-yl)-4H-pyridin-4-ide;6-(2,6-dimethylphenyl)-5-(1-methylpyrazol-3-yl)-4H-pyrimidin-4-ide;2-(2,6-dimethylphenyl)-3-pyrazol-1-yl-4H-pyridin-4-ide;tetrakis(iridium) is sourced from PubChem (CID 159227829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).