2-(3H-dibenzofuran-3-id-4-yl)-4,5-dimethylpyridine;2-(3H-dibenzofuran-3-id-4-yl)-4-(4-methylphenyl)pyridine;2-(3H-dibenzofuran-3-id-4-yl)-4-methylpyridine;bis(4-hydroxypent-3-en-2-one);octakis(iridium);bis(2-(6-methyl-3H-dibenzofuran-3-id-4-yl)-4-phenylpyridine);4-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;bis(4-methyl-5-phenyl-2-phenylpyridine);tetrakis(5-methyl-2-phenylpyridine);bis(2-phenylpyridine)

C243H188Ir8N14O9-14 — CID 157187118

About 2-(3H-dibenzofuran-3-id-4-yl)-4,5-dimethylpyridine;2-(3H-dibenzofuran-3-id-4-yl)-4-(4-methylphenyl)pyridine;2-(3H-dibenzofuran-3-id-4-yl)-4-methylpyridine;bis(4-hydroxypent-3-en-2-one);octakis(iridium);bis(2-(6-methyl-3H-dibenzofuran-3-id-4-yl)-4-phenylpyridine);4-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;bis(4-methyl-5-phenyl-2-phenylpyridine);tetrakis(5-methyl-2-phenylpyridine);bis(2-phenylpyridine)

2-(3H-dibenzofuran-3-id-4-yl)-4,5-dimethylpyridine;2-(3H-dibenzofuran-3-id-4-yl)-4-(4-methylphenyl)pyridine;2-(3H-dibenzofuran-3-id-4-yl)-4-methylpyridine;bis(4-hydroxypent-3-en-2-one);octakis(iridium);bis(2-(6-methyl-3H-dibenzofuran-3-id-4-yl)-4-phenylpyridine);4-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;bis(4-methyl-5-phenyl-2-phenylpyridine);tetrakis(5-methyl-2-phenylpyridine);bis(2-phenylpyridine) (PubChem CID 157187118) has the molecular formula C243H188Ir8N14O9-14 and a molecular weight of 4986.00 g/mol. Its IUPAC name is 2-(3H-dibenzofuran-3-id-4-yl)-4,5-dimethylpyridine;2-(3H-dibenzofuran-3-id-4-yl)-4-(4-methylphenyl)pyridine;2-(3H-dibenzofuran-3-id-4-yl)-4-methylpyridine;bis(4-hydroxypent-3-en-2-one);octakis(iridium);bis(2-(6-methyl-3H-dibenzofuran-3-id-4-yl)-4-phenylpyridine);4-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;bis(4-methyl-5-phenyl-2-phenylpyridine);tetrakis(5-methyl-2-phenylpyridine);bis(2-phenylpyridine).

Molecular Properties

• Compound Name: 2-(3H-dibenzofuran-3-id-4-yl)-4,5-dimethylpyridine;2-(3H-dibenzofuran-3-id-4-yl)-4-(4-methylphenyl)pyridine;2-(3H-dibenzofuran-3-id-4-yl)-4-methylpyridine;bis(4-hydroxypent-3-en-2-one);octakis(iridium);bis(2-(6-methyl-3H-dibenzofuran-3-id-4-yl)-4-phenylpyridine);4-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;bis(4-methyl-5-phenyl-2-phenylpyridine);tetrakis(5-methyl-2-phenylpyridine);bis(2-phenylpyridine)
• PubChem CID: 157187118
• Molecular Formula: C243H188Ir8N14O9-14
• Molecular Weight: 4986.00 g/mol
• Exact Mass: 4989.18
• IUPAC Name: 2-(3H-dibenzofuran-3-id-4-yl)-4,5-dimethylpyridine;2-(3H-dibenzofuran-3-id-4-yl)-4-(4-methylphenyl)pyridine;2-(3H-dibenzofuran-3-id-4-yl)-4-methylpyridine;bis(4-hydroxypent-3-en-2-one);octakis(iridium);bis(2-(6-methyl-3H-dibenzofuran-3-id-4-yl)-4-phenylpyridine);4-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;bis(4-methyl-5-phenyl-2-phenylpyridine);tetrakis(5-methyl-2-phenylpyridine);bis(2-phenylpyridine)
• SMILES: CC(=O)C=C(C)O.CC(=O)C=C(C)O.Cc1cc(-c2[c-]cccc2)ncc1-c1ccccc1.Cc1cc(-c2[c-]cccc2)ncc1-c1ccccc1.Cc1ccc(-c2[c-]cccc2)nc1.Cc1ccc(-c2[c-]cccc2)nc1.Cc1ccc(-c2[c-]cccc2)nc1.Cc1ccc(-c2[c-]cccc2)nc1.Cc1ccc(-c2ccnc(-c3[c-]ccc4c3oc3ccccc34)c2)cc1.Cc1cccc2c1oc1c(-c3cc(-c4ccccc4)ccn3)[c-]ccc12.Cc1cccc2c1oc1c(-c3cc(-c4ccccc4)ccn3)[c-]ccc12.Cc1ccnc(-c2[c-]ccc(-c3ccccc3)c2)c1.Cc1ccnc(-c2[c-]ccc3c2oc2ccccc23)c1.Cc1cnc(-c2[c-]ccc3c2oc2ccccc23)cc1C.[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1
• InChI: InChI=1S/3C24H16NO.C19H14NO.C18H12NO.3C18H14N.4C12H10N.2C11H8N.2C5H8O2.8Ir/c1-16-9-11-17(12-10-16)18-13-14-25-22(15-18)21-7-4-6-20-19-5-2-3-8-23(19)26-24(20)21;2*1-16-7-5-10-19-20-11-6-12-21(24(20)26-23(16)19)22-15-18(13-14-25-22)17-8-3-2-4-9-17;1-12-10-17(20-11-13(12)2)16-8-5-7-15-14-6-3-4-9-18(14)21-19(15)16;1-12-9-10-19-16(11-12)15-7-4-6-14-13-5-2-3-8-17(13)20-18(14)15;2*1-14-12-18(16-10-6-3-7-11-16)19-13-17(14)15-8-4-2-5-9-15;1-14-10-11-19-18(12-14)17-9-5-8-16(13-17)15-6-3-2-4-7-15;4*1-10-7-8-12(13-9-10)11-5-3-2-4-6-11;2*1-2-6-10(7-3-1)11-8-4-5-9-12-11;2*1-4(6)3-5(2)7;;;;;;;;/h2-6,8-15H,1H3;2*2-11,13-15H,1H3;3-7,9-11H,1-2H3;2-6,8-11H,1H3;2*2-10,12-13H,1H3;2-8,10-13H,1H3;4*2-5,7-9H,1H3;2*1-6,8-9H;2*3,6H,1-2H3;;;;;;;;/q14*-1
• InChIKey: MISBTDLWUFIZOK-UHFFFAOYSA-N
• XLogP: 61.25
• TPSA: 320.76 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 23
• Rotatable Bonds: 22
• Heavy Atoms: 274
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	4986.00
LogP ≤ 5	61.25
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	23

Frequently Asked Questions

What is the IUPAC name of 2-(3H-dibenzofuran-3-id-4-yl)-4,5-dimethylpyridine;2-(3H-dibenzofuran-3-id-4-yl)-4-(4-methylphenyl)pyridine;2-(3H-dibenzofuran-3-id-4-yl)-4-methylpyridine;bis(4-hydroxypent-3-en-2-one);octakis(iridium);bis(2-(6-methyl-3H-dibenzofuran-3-id-4-yl)-4-phenylpyridine);4-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;bis(4-methyl-5-phenyl-2-phenylpyridine);tetrakis(5-methyl-2-phenylpyridine);bis(2-phenylpyridine)?

The IUPAC name of 2-(3H-dibenzofuran-3-id-4-yl)-4,5-dimethylpyridine;2-(3H-dibenzofuran-3-id-4-yl)-4-(4-methylphenyl)pyridine;2-(3H-dibenzofuran-3-id-4-yl)-4-methylpyridine;bis(4-hydroxypent-3-en-2-one);octakis(iridium);bis(2-(6-methyl-3H-dibenzofuran-3-id-4-yl)-4-phenylpyridine);4-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;bis(4-methyl-5-phenyl-2-phenylpyridine);tetrakis(5-methyl-2-phenylpyridine);bis(2-phenylpyridine) (CID 157187118) is 2-(3H-dibenzofuran-3-id-4-yl)-4,5-dimethylpyridine;2-(3H-dibenzofuran-3-id-4-yl)-4-(4-methylphenyl)pyridine;2-(3H-dibenzofuran-3-id-4-yl)-4-methylpyridine;bis(4-hydroxypent-3-en-2-one);octakis(iridium);bis(2-(6-methyl-3H-dibenzofuran-3-id-4-yl)-4-phenylpyridine);4-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;bis(4-methyl-5-phenyl-2-phenylpyridine);tetrakis(5-methyl-2-phenylpyridine);bis(2-phenylpyridine).

What is the SMILES notation for 2-(3H-dibenzofuran-3-id-4-yl)-4,5-dimethylpyridine;2-(3H-dibenzofuran-3-id-4-yl)-4-(4-methylphenyl)pyridine;2-(3H-dibenzofuran-3-id-4-yl)-4-methylpyridine;bis(4-hydroxypent-3-en-2-one);octakis(iridium);bis(2-(6-methyl-3H-dibenzofuran-3-id-4-yl)-4-phenylpyridine);4-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;bis(4-methyl-5-phenyl-2-phenylpyridine);tetrakis(5-methyl-2-phenylpyridine);bis(2-phenylpyridine)?

The canonical SMILES for 2-(3H-dibenzofuran-3-id-4-yl)-4,5-dimethylpyridine;2-(3H-dibenzofuran-3-id-4-yl)-4-(4-methylphenyl)pyridine;2-(3H-dibenzofuran-3-id-4-yl)-4-methylpyridine;bis(4-hydroxypent-3-en-2-one);octakis(iridium);bis(2-(6-methyl-3H-dibenzofuran-3-id-4-yl)-4-phenylpyridine);4-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;bis(4-methyl-5-phenyl-2-phenylpyridine);tetrakis(5-methyl-2-phenylpyridine);bis(2-phenylpyridine) is CC(=O)C=C(C)O.CC(=O)C=C(C)O.Cc1cc(-c2[c-]cccc2)ncc1-c1ccccc1.Cc1cc(-c2[c-]cccc2)ncc1-c1ccccc1.Cc1ccc(-c2[c-]cccc2)nc1.Cc1ccc(-c2[c-]cccc2)nc1.Cc1ccc(-c2[c-]cccc2)nc1.Cc1ccc(-c2[c-]cccc2)nc1.Cc1ccc(-c2ccnc(-c3[c-]ccc4c3oc3ccccc34)c2)cc1.Cc1cccc2c1oc1c(-c3cc(-c4ccccc4)ccn3)[c-]ccc12.Cc1cccc2c1oc1c(-c3cc(-c4ccccc4)ccn3)[c-]ccc12.Cc1ccnc(-c2[c-]ccc(-c3ccccc3)c2)c1.Cc1ccnc(-c2[c-]ccc3c2oc2ccccc23)c1.Cc1cnc(-c2[c-]ccc3c2oc2ccccc23)cc1C.[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.

What is the InChIKey of 2-(3H-dibenzofuran-3-id-4-yl)-4,5-dimethylpyridine;2-(3H-dibenzofuran-3-id-4-yl)-4-(4-methylphenyl)pyridine;2-(3H-dibenzofuran-3-id-4-yl)-4-methylpyridine;bis(4-hydroxypent-3-en-2-one);octakis(iridium);bis(2-(6-methyl-3H-dibenzofuran-3-id-4-yl)-4-phenylpyridine);4-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;bis(4-methyl-5-phenyl-2-phenylpyridine);tetrakis(5-methyl-2-phenylpyridine);bis(2-phenylpyridine)?

The InChIKey is MISBTDLWUFIZOK-UHFFFAOYSA-N. The full InChI is InChI=1S/3C24H16NO.C19H14NO.C18H12NO.3C18H14N.4C12H10N.2C11H8N.2C5H8O2.8Ir/c1-16-9-11-17(12-10-16)18-13-14-25-22(15-18)21-7-4-6-20-19-5-2-3-8-23(19)26-24(20)21;2*1-16-7-5-10-19-20-11-6-12-21(24(20)26-23(16)19)22-15-18(13-14-25-22)17-8-3-2-4-9-17;1-12-10-17(20-11-13(12)2)16-8-5-7-15-14-6-3-4-9-18(14)21-19(15)16;1-12-9-10-19-16(11-12)15-7-4-6-14-13-5-2-3-8-17(13)20-18(14)15;2*1-14-12-18(16-10-6-3-7-11-16)19-13-17(14)15-8-4-2-5-9-15;1-14-10-11-19-18(12-14)17-9-5-8-16(13-17)15-6-3-2-4-7-15;4*1-10-7-8-12(13-9-10)11-5-3-2-4-6-11;2*1-2-6-10(7-3-1)11-8-4-5-9-12-11;2*1-4(6)3-5(2)7;;;;;;;;/h2-6,8-15H,1H3;2*2-11,13-15H,1H3;3-7,9-11H,1-2H3;2-6,8-11H,1H3;2*2-10,12-13H,1H3;2-8,10-13H,1H3;4*2-5,7-9H,1H3;2*1-6,8-9H;2*3,6H,1-2H3;;;;;;;;/q14*-1;;;;;;;;;;.

What are the key properties of 2-(3H-dibenzofuran-3-id-4-yl)-4,5-dimethylpyridine;2-(3H-dibenzofuran-3-id-4-yl)-4-(4-methylphenyl)pyridine;2-(3H-dibenzofuran-3-id-4-yl)-4-methylpyridine;bis(4-hydroxypent-3-en-2-one);octakis(iridium);bis(2-(6-methyl-3H-dibenzofuran-3-id-4-yl)-4-phenylpyridine);4-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;bis(4-methyl-5-phenyl-2-phenylpyridine);tetrakis(5-methyl-2-phenylpyridine);bis(2-phenylpyridine)?

2-(3H-dibenzofuran-3-id-4-yl)-4,5-dimethylpyridine;2-(3H-dibenzofuran-3-id-4-yl)-4-(4-methylphenyl)pyridine;2-(3H-dibenzofuran-3-id-4-yl)-4-methylpyridine;bis(4-hydroxypent-3-en-2-one);octakis(iridium);bis(2-(6-methyl-3H-dibenzofuran-3-id-4-yl)-4-phenylpyridine);4-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;bis(4-methyl-5-phenyl-2-phenylpyridine);tetrakis(5-methyl-2-phenylpyridine);bis(2-phenylpyridine) has a molecular weight of 4986.00 g/mol, XLogP of 61.25, 22 rotatable bonds, 2 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(3H-dibenzofuran-3-id-4-yl)-4,5-dimethylpyridine;2-(3H-dibenzofuran-3-id-4-yl)-4-(4-methylphenyl)pyridine;2-(3H-dibenzofuran-3-id-4-yl)-4-methylpyridine;bis(4-hydroxypent-3-en-2-one);octakis(iridium);bis(2-(6-methyl-3H-dibenzofuran-3-id-4-yl)-4-phenylpyridine);4-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;bis(4-methyl-5-phenyl-2-phenylpyridine);tetrakis(5-methyl-2-phenylpyridine);bis(2-phenylpyridine) is sourced from PubChem (CID 157187118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).