2,6-dimethyl-4-[4-[3-(6-phenylhexyl)phenyl]-2-pyridinyl]-3H-pyridin-3-ide;tetrakis(iridium);bis(5-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine);5-methyl-2-[3-[2-(4-phenylcyclohexyl)phenyl]benzene-6-id-1-yl]pyridine;2-(3H-naphthalen-3-id-2-yl)-5-[3-(8-phenyloctyl)phenyl]pyridine;2-(4-phenylbenzene-6-id-1-yl)-5-(5-phenylpentyl)pyridine

C159H147Ir4N7-6 — CID 159007641

About 2,6-dimethyl-4-[4-[3-(6-phenylhexyl)phenyl]-2-pyridinyl]-3H-pyridin-3-ide;tetrakis(iridium);bis(5-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine);5-methyl-2-[3-[2-(4-phenylcyclohexyl)phenyl]benzene-6-id-1-yl]pyridine;2-(3H-naphthalen-3-id-2-yl)-5-[3-(8-phenyloctyl)phenyl]pyridine;2-(4-phenylbenzene-6-id-1-yl)-5-(5-phenylpentyl)pyridine

2,6-dimethyl-4-[4-[3-(6-phenylhexyl)phenyl]-2-pyridinyl]-3H-pyridin-3-ide;tetrakis(iridium);bis(5-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine);5-methyl-2-[3-[2-(4-phenylcyclohexyl)phenyl]benzene-6-id-1-yl]pyridine;2-(3H-naphthalen-3-id-2-yl)-5-[3-(8-phenyloctyl)phenyl]pyridine;2-(4-phenylbenzene-6-id-1-yl)-5-(5-phenylpentyl)pyridine (PubChem CID 159007641) has the molecular formula C159H147Ir4N7-6 and a molecular weight of 2924.84 g/mol. Its IUPAC name is 2,6-dimethyl-4-[4-[3-(6-phenylhexyl)phenyl]-2-pyridinyl]-3H-pyridin-3-ide;tetrakis(iridium);bis(5-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine);5-methyl-2-[3-[2-(4-phenylcyclohexyl)phenyl]benzene-6-id-1-yl]pyridine;2-(3H-naphthalen-3-id-2-yl)-5-[3-(8-phenyloctyl)phenyl]pyridine;2-(4-phenylbenzene-6-id-1-yl)-5-(5-phenylpentyl)pyridine.

Molecular Properties

• Compound Name: 2,6-dimethyl-4-[4-[3-(6-phenylhexyl)phenyl]-2-pyridinyl]-3H-pyridin-3-ide;tetrakis(iridium);bis(5-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine);5-methyl-2-[3-[2-(4-phenylcyclohexyl)phenyl]benzene-6-id-1-yl]pyridine;2-(3H-naphthalen-3-id-2-yl)-5-[3-(8-phenyloctyl)phenyl]pyridine;2-(4-phenylbenzene-6-id-1-yl)-5-(5-phenylpentyl)pyridine
• PubChem CID: 159007641
• Molecular Formula: C159H147Ir4N7-6
• Molecular Weight: 2924.84 g/mol
• Exact Mass: 2926.03
• IUPAC Name: 2,6-dimethyl-4-[4-[3-(6-phenylhexyl)phenyl]-2-pyridinyl]-3H-pyridin-3-ide;tetrakis(iridium);bis(5-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine);5-methyl-2-[3-[2-(4-phenylcyclohexyl)phenyl]benzene-6-id-1-yl]pyridine;2-(3H-naphthalen-3-id-2-yl)-5-[3-(8-phenyloctyl)phenyl]pyridine;2-(4-phenylbenzene-6-id-1-yl)-5-(5-phenylpentyl)pyridine
• SMILES: Cc1[c-]c(-c2cc(-c3cccc(CCCCCCc4ccccc4)c3)ccn2)cc(C)n1.Cc1ccc(-c2[c-]ccc(-c3ccccc3)c2)nc1.Cc1ccc(-c2[c-]ccc(-c3ccccc3)c2)nc1.Cc1ccc(-c2[c-]ccc(-c3ccccc3C3CCC(c4ccccc4)CC3)c2)nc1.[Ir].[Ir].[Ir].[Ir].[c-]1cc(-c2ccccc2)ccc1-c1ccc(CCCCCc2ccccc2)cn1.[c-]1cc2ccccc2cc1-c1ccc(-c2cccc(CCCCCCCCc3ccccc3)c2)cn1
• InChI: InChI=1S/C35H34N.C30H31N2.C30H28N.C28H26N.2C18H14N.4Ir/c1(3-6-13-28-14-8-5-9-15-28)2-4-7-16-29-17-12-20-31(25-29)34-23-24-35(36-27-34)33-22-21-30-18-10-11-19-32(30)26-33;1-23-19-29(20-24(2)32-23)30-22-28(17-18-31-30)27-16-10-15-26(21-27)14-7-4-3-6-11-25-12-8-5-9-13-25;1-22-14-19-30(31-21-22)27-11-7-10-26(20-27)29-13-6-5-12-28(29)25-17-15-24(16-18-25)23-8-3-2-4-9-23;1-4-10-23(11-5-1)12-6-2-7-13-24-16-21-28(29-22-24)27-19-17-26(18-20-27)25-14-8-3-9-15-25;2*1-14-10-11-18(19-13-14)17-9-5-8-16(12-17)15-6-3-2-4-7-15;;;;/h5,8-12,14-15,17-21,23-27H,1-4,6-7,13,16H2;5,8-10,12-13,15-19,21-22H,3-4,6-7,11,14H2,1-2H3;2-10,12-14,19-21,24-25H,15-18H2,1H3;1,3-5,8-11,14-19,21-22H,2,6-7,12-13H2;2*2-8,10-13H,1H3;;;;/q6*-1
• InChIKey: SDMVMVKXJOTLTM-UHFFFAOYSA-N
• XLogP: 41.24
• TPSA: 90.23 Ų
• H-Bond Acceptors: 7
• Rotatable Bonds: 36
• Heavy Atoms: 170
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2924.84
LogP ≤ 5	41.24
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	7

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-4-[4-[3-(6-phenylhexyl)phenyl]-2-pyridinyl]-3H-pyridin-3-ide;tetrakis(iridium);bis(5-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine);5-methyl-2-[3-[2-(4-phenylcyclohexyl)phenyl]benzene-6-id-1-yl]pyridine;2-(3H-naphthalen-3-id-2-yl)-5-[3-(8-phenyloctyl)phenyl]pyridine;2-(4-phenylbenzene-6-id-1-yl)-5-(5-phenylpentyl)pyridine?

The IUPAC name of 2,6-dimethyl-4-[4-[3-(6-phenylhexyl)phenyl]-2-pyridinyl]-3H-pyridin-3-ide;tetrakis(iridium);bis(5-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine);5-methyl-2-[3-[2-(4-phenylcyclohexyl)phenyl]benzene-6-id-1-yl]pyridine;2-(3H-naphthalen-3-id-2-yl)-5-[3-(8-phenyloctyl)phenyl]pyridine;2-(4-phenylbenzene-6-id-1-yl)-5-(5-phenylpentyl)pyridine (CID 159007641) is 2,6-dimethyl-4-[4-[3-(6-phenylhexyl)phenyl]-2-pyridinyl]-3H-pyridin-3-ide;tetrakis(iridium);bis(5-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine);5-methyl-2-[3-[2-(4-phenylcyclohexyl)phenyl]benzene-6-id-1-yl]pyridine;2-(3H-naphthalen-3-id-2-yl)-5-[3-(8-phenyloctyl)phenyl]pyridine;2-(4-phenylbenzene-6-id-1-yl)-5-(5-phenylpentyl)pyridine.

What is the SMILES notation for 2,6-dimethyl-4-[4-[3-(6-phenylhexyl)phenyl]-2-pyridinyl]-3H-pyridin-3-ide;tetrakis(iridium);bis(5-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine);5-methyl-2-[3-[2-(4-phenylcyclohexyl)phenyl]benzene-6-id-1-yl]pyridine;2-(3H-naphthalen-3-id-2-yl)-5-[3-(8-phenyloctyl)phenyl]pyridine;2-(4-phenylbenzene-6-id-1-yl)-5-(5-phenylpentyl)pyridine?

The canonical SMILES for 2,6-dimethyl-4-[4-[3-(6-phenylhexyl)phenyl]-2-pyridinyl]-3H-pyridin-3-ide;tetrakis(iridium);bis(5-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine);5-methyl-2-[3-[2-(4-phenylcyclohexyl)phenyl]benzene-6-id-1-yl]pyridine;2-(3H-naphthalen-3-id-2-yl)-5-[3-(8-phenyloctyl)phenyl]pyridine;2-(4-phenylbenzene-6-id-1-yl)-5-(5-phenylpentyl)pyridine is Cc1[c-]c(-c2cc(-c3cccc(CCCCCCc4ccccc4)c3)ccn2)cc(C)n1.Cc1ccc(-c2[c-]ccc(-c3ccccc3)c2)nc1.Cc1ccc(-c2[c-]ccc(-c3ccccc3)c2)nc1.Cc1ccc(-c2[c-]ccc(-c3ccccc3C3CCC(c4ccccc4)CC3)c2)nc1.[Ir].[Ir].[Ir].[Ir].[c-]1cc(-c2ccccc2)ccc1-c1ccc(CCCCCc2ccccc2)cn1.[c-]1cc2ccccc2cc1-c1ccc(-c2cccc(CCCCCCCCc3ccccc3)c2)cn1.

What is the InChIKey of 2,6-dimethyl-4-[4-[3-(6-phenylhexyl)phenyl]-2-pyridinyl]-3H-pyridin-3-ide;tetrakis(iridium);bis(5-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine);5-methyl-2-[3-[2-(4-phenylcyclohexyl)phenyl]benzene-6-id-1-yl]pyridine;2-(3H-naphthalen-3-id-2-yl)-5-[3-(8-phenyloctyl)phenyl]pyridine;2-(4-phenylbenzene-6-id-1-yl)-5-(5-phenylpentyl)pyridine?

The InChIKey is SDMVMVKXJOTLTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H34N.C30H31N2.C30H28N.C28H26N.2C18H14N.4Ir/c1(3-6-13-28-14-8-5-9-15-28)2-4-7-16-29-17-12-20-31(25-29)34-23-24-35(36-27-34)33-22-21-30-18-10-11-19-32(30)26-33;1-23-19-29(20-24(2)32-23)30-22-28(17-18-31-30)27-16-10-15-26(21-27)14-7-4-3-6-11-25-12-8-5-9-13-25;1-22-14-19-30(31-21-22)27-11-7-10-26(20-27)29-13-6-5-12-28(29)25-17-15-24(16-18-25)23-8-3-2-4-9-23;1-4-10-23(11-5-1)12-6-2-7-13-24-16-21-28(29-22-24)27-19-17-26(18-20-27)25-14-8-3-9-15-25;2*1-14-10-11-18(19-13-14)17-9-5-8-16(12-17)15-6-3-2-4-7-15;;;;/h5,8-12,14-15,17-21,23-27H,1-4,6-7,13,16H2;5,8-10,12-13,15-19,21-22H,3-4,6-7,11,14H2,1-2H3;2-10,12-14,19-21,24-25H,15-18H2,1H3;1,3-5,8-11,14-19,21-22H,2,6-7,12-13H2;2*2-8,10-13H,1H3;;;;/q6*-1;;;;.

What are the key properties of 2,6-dimethyl-4-[4-[3-(6-phenylhexyl)phenyl]-2-pyridinyl]-3H-pyridin-3-ide;tetrakis(iridium);bis(5-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine);5-methyl-2-[3-[2-(4-phenylcyclohexyl)phenyl]benzene-6-id-1-yl]pyridine;2-(3H-naphthalen-3-id-2-yl)-5-[3-(8-phenyloctyl)phenyl]pyridine;2-(4-phenylbenzene-6-id-1-yl)-5-(5-phenylpentyl)pyridine?

2,6-dimethyl-4-[4-[3-(6-phenylhexyl)phenyl]-2-pyridinyl]-3H-pyridin-3-ide;tetrakis(iridium);bis(5-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine);5-methyl-2-[3-[2-(4-phenylcyclohexyl)phenyl]benzene-6-id-1-yl]pyridine;2-(3H-naphthalen-3-id-2-yl)-5-[3-(8-phenyloctyl)phenyl]pyridine;2-(4-phenylbenzene-6-id-1-yl)-5-(5-phenylpentyl)pyridine has a molecular weight of 2924.84 g/mol, XLogP of 41.24, 36 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 2,6-dimethyl-4-[4-[3-(6-phenylhexyl)phenyl]-2-pyridinyl]-3H-pyridin-3-ide;tetrakis(iridium);bis(5-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine);5-methyl-2-[3-[2-(4-phenylcyclohexyl)phenyl]benzene-6-id-1-yl]pyridine;2-(3H-naphthalen-3-id-2-yl)-5-[3-(8-phenyloctyl)phenyl]pyridine;2-(4-phenylbenzene-6-id-1-yl)-5-(5-phenylpentyl)pyridine is sourced from PubChem (CID 159007641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).