2,4-dimethyl-6-phenylpyridine;4,5-dimethyl-2-phenylpyridine;tetrakis(iridium);bis(4-methyl-5-phenyl-2-phenylpyridine);3-methyl-2-phenylpyridine;4-phenyl-2-phenylpyridine;bis(2-phenylpyridine)

C113H90Ir4N8-8 — CID 157151192

About 2,4-dimethyl-6-phenylpyridine;4,5-dimethyl-2-phenylpyridine;tetrakis(iridium);bis(4-methyl-5-phenyl-2-phenylpyridine);3-methyl-2-phenylpyridine;4-phenyl-2-phenylpyridine;bis(2-phenylpyridine)

2,4-dimethyl-6-phenylpyridine;4,5-dimethyl-2-phenylpyridine;tetrakis(iridium);bis(4-methyl-5-phenyl-2-phenylpyridine);3-methyl-2-phenylpyridine;4-phenyl-2-phenylpyridine;bis(2-phenylpyridine) (PubChem CID 157151192) has the molecular formula C113H90Ir4N8-8 and a molecular weight of 2328.89 g/mol. Its IUPAC name is 2,4-dimethyl-6-phenylpyridine;4,5-dimethyl-2-phenylpyridine;tetrakis(iridium);bis(4-methyl-5-phenyl-2-phenylpyridine);3-methyl-2-phenylpyridine;4-phenyl-2-phenylpyridine;bis(2-phenylpyridine).

Molecular Properties

• Compound Name: 2,4-dimethyl-6-phenylpyridine;4,5-dimethyl-2-phenylpyridine;tetrakis(iridium);bis(4-methyl-5-phenyl-2-phenylpyridine);3-methyl-2-phenylpyridine;4-phenyl-2-phenylpyridine;bis(2-phenylpyridine)
• PubChem CID: 157151192
• Molecular Formula: C113H90Ir4N8-8
• Molecular Weight: 2328.89 g/mol
• Exact Mass: 2330.58
• IUPAC Name: 2,4-dimethyl-6-phenylpyridine;4,5-dimethyl-2-phenylpyridine;tetrakis(iridium);bis(4-methyl-5-phenyl-2-phenylpyridine);3-methyl-2-phenylpyridine;4-phenyl-2-phenylpyridine;bis(2-phenylpyridine)
• SMILES: Cc1cc(-c2[c-]cccc2)ncc1-c1ccccc1.Cc1cc(-c2[c-]cccc2)ncc1-c1ccccc1.Cc1cc(C)nc(-c2[c-]cccc2)c1.Cc1cccnc1-c1[c-]cccc1.Cc1cnc(-c2[c-]cccc2)cc1C.[Ir].[Ir].[Ir].[Ir].[c-]1ccccc1-c1cc(-c2ccccc2)ccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1
• InChI: InChI=1S/2C18H14N.C17H12N.2C13H12N.C12H10N.2C11H8N.4Ir/c2*1-14-12-18(16-10-6-3-7-11-16)19-13-17(14)15-8-4-2-5-9-15;1-3-7-14(8-4-1)16-11-12-18-17(13-16)15-9-5-2-6-10-15;1-10-8-13(14-9-11(10)2)12-6-4-3-5-7-12;1-10-8-11(2)14-13(9-10)12-6-4-3-5-7-12;1-10-6-5-9-13-12(10)11-7-3-2-4-8-11;2*1-2-6-10(7-3-1)11-8-4-5-9-12-11;;;;/h2*2-10,12-13H,1H3;1-9,11-13H;2*3-6,8-9H,1-2H3;2-7,9H,1H3;2*1-6,8-9H;;;;/q8*-1
• InChIKey: LGISDHIHHJNNET-UHFFFAOYSA-N
• XLogP: 27.54
• TPSA: 103.12 Ų
• H-Bond Acceptors: 8
• Rotatable Bonds: 11
• Heavy Atoms: 125
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2328.89
LogP ≤ 5	27.54
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 2,4-dimethyl-6-phenylpyridine;4,5-dimethyl-2-phenylpyridine;tetrakis(iridium);bis(4-methyl-5-phenyl-2-phenylpyridine);3-methyl-2-phenylpyridine;4-phenyl-2-phenylpyridine;bis(2-phenylpyridine)?

The IUPAC name of 2,4-dimethyl-6-phenylpyridine;4,5-dimethyl-2-phenylpyridine;tetrakis(iridium);bis(4-methyl-5-phenyl-2-phenylpyridine);3-methyl-2-phenylpyridine;4-phenyl-2-phenylpyridine;bis(2-phenylpyridine) (CID 157151192) is 2,4-dimethyl-6-phenylpyridine;4,5-dimethyl-2-phenylpyridine;tetrakis(iridium);bis(4-methyl-5-phenyl-2-phenylpyridine);3-methyl-2-phenylpyridine;4-phenyl-2-phenylpyridine;bis(2-phenylpyridine).

What is the SMILES notation for 2,4-dimethyl-6-phenylpyridine;4,5-dimethyl-2-phenylpyridine;tetrakis(iridium);bis(4-methyl-5-phenyl-2-phenylpyridine);3-methyl-2-phenylpyridine;4-phenyl-2-phenylpyridine;bis(2-phenylpyridine)?

The canonical SMILES for 2,4-dimethyl-6-phenylpyridine;4,5-dimethyl-2-phenylpyridine;tetrakis(iridium);bis(4-methyl-5-phenyl-2-phenylpyridine);3-methyl-2-phenylpyridine;4-phenyl-2-phenylpyridine;bis(2-phenylpyridine) is Cc1cc(-c2[c-]cccc2)ncc1-c1ccccc1.Cc1cc(-c2[c-]cccc2)ncc1-c1ccccc1.Cc1cc(C)nc(-c2[c-]cccc2)c1.Cc1cccnc1-c1[c-]cccc1.Cc1cnc(-c2[c-]cccc2)cc1C.[Ir].[Ir].[Ir].[Ir].[c-]1ccccc1-c1cc(-c2ccccc2)ccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.

What is the InChIKey of 2,4-dimethyl-6-phenylpyridine;4,5-dimethyl-2-phenylpyridine;tetrakis(iridium);bis(4-methyl-5-phenyl-2-phenylpyridine);3-methyl-2-phenylpyridine;4-phenyl-2-phenylpyridine;bis(2-phenylpyridine)?

The InChIKey is LGISDHIHHJNNET-UHFFFAOYSA-N. The full InChI is InChI=1S/2C18H14N.C17H12N.2C13H12N.C12H10N.2C11H8N.4Ir/c2*1-14-12-18(16-10-6-3-7-11-16)19-13-17(14)15-8-4-2-5-9-15;1-3-7-14(8-4-1)16-11-12-18-17(13-16)15-9-5-2-6-10-15;1-10-8-13(14-9-11(10)2)12-6-4-3-5-7-12;1-10-8-11(2)14-13(9-10)12-6-4-3-5-7-12;1-10-6-5-9-13-12(10)11-7-3-2-4-8-11;2*1-2-6-10(7-3-1)11-8-4-5-9-12-11;;;;/h2*2-10,12-13H,1H3;1-9,11-13H;2*3-6,8-9H,1-2H3;2-7,9H,1H3;2*1-6,8-9H;;;;/q8*-1;;;;.

What are the key properties of 2,4-dimethyl-6-phenylpyridine;4,5-dimethyl-2-phenylpyridine;tetrakis(iridium);bis(4-methyl-5-phenyl-2-phenylpyridine);3-methyl-2-phenylpyridine;4-phenyl-2-phenylpyridine;bis(2-phenylpyridine)?

2,4-dimethyl-6-phenylpyridine;4,5-dimethyl-2-phenylpyridine;tetrakis(iridium);bis(4-methyl-5-phenyl-2-phenylpyridine);3-methyl-2-phenylpyridine;4-phenyl-2-phenylpyridine;bis(2-phenylpyridine) has a molecular weight of 2328.89 g/mol, XLogP of 27.54, 11 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 2,4-dimethyl-6-phenylpyridine;4,5-dimethyl-2-phenylpyridine;tetrakis(iridium);bis(4-methyl-5-phenyl-2-phenylpyridine);3-methyl-2-phenylpyridine;4-phenyl-2-phenylpyridine;bis(2-phenylpyridine) is sourced from PubChem (CID 157151192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).