2-(2,4-difluorobenzene-6-id-1-yl)-4-methylpyridine;[2-(2,4-difluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;2-(4-fluorobenzene-6-id-1-yl)-4-methylpyridine;1-[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]-N-methylmethanamine;bis(4-hydroxypent-3-en-2-one);tetrakis(iridium);2-phenylphenol;platinum;2-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine

C87H74F6Ir4N7O6Pt-5 — CID 161413848

About 2-(2,4-difluorobenzene-6-id-1-yl)-4-methylpyridine;[2-(2,4-difluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;2-(4-fluorobenzene-6-id-1-yl)-4-methylpyridine;1-[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]-N-methylmethanamine;bis(4-hydroxypent-3-en-2-one);tetrakis(iridium);2-phenylphenol;platinum;2-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine

2-(2,4-difluorobenzene-6-id-1-yl)-4-methylpyridine;[2-(2,4-difluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;2-(4-fluorobenzene-6-id-1-yl)-4-methylpyridine;1-[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]-N-methylmethanamine;bis(4-hydroxypent-3-en-2-one);tetrakis(iridium);2-phenylphenol;platinum;2-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine (PubChem CID 161413848) has the molecular formula C87H74F6Ir4N7O6Pt-5 and a molecular weight of 2391.53 g/mol. Its IUPAC name is 2-(2,4-difluorobenzene-6-id-1-yl)-4-methylpyridine;[2-(2,4-difluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;2-(4-fluorobenzene-6-id-1-yl)-4-methylpyridine;1-[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]-N-methylmethanamine;bis(4-hydroxypent-3-en-2-one);tetrakis(iridium);2-phenylphenol;platinum;2-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine.

Molecular Properties

• Compound Name: 2-(2,4-difluorobenzene-6-id-1-yl)-4-methylpyridine;[2-(2,4-difluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;2-(4-fluorobenzene-6-id-1-yl)-4-methylpyridine;1-[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]-N-methylmethanamine;bis(4-hydroxypent-3-en-2-one);tetrakis(iridium);2-phenylphenol;platinum;2-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine
• PubChem CID: 161413848
• Molecular Formula: C87H74F6Ir4N7O6Pt-5
• Molecular Weight: 2391.53 g/mol
• Exact Mass: 2393.38
• IUPAC Name: 2-(2,4-difluorobenzene-6-id-1-yl)-4-methylpyridine;[2-(2,4-difluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;2-(4-fluorobenzene-6-id-1-yl)-4-methylpyridine;1-[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]-N-methylmethanamine;bis(4-hydroxypent-3-en-2-one);tetrakis(iridium);2-phenylphenol;platinum;2-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine
• SMILES: CC(=O)C=C(C)O.CC(=O)C=C(C)O.CNCc1ccnc(-c2[c-]cc(F)cc2)c1.Cc1ccnc(-c2[c-]cc(F)cc2)c1.Cc1ccnc(-c2[c-]cc(F)cc2F)c1.OCc1ccnc(-c2[c-]cc(F)cc2F)c1.Oc1ccccc1-c1ccccc1.[Ir].[Ir].[Ir].[Ir].[Pt].[c-]1c(-c2ccccn2)cccc1-c1ccccn1
• InChI: InChI=1S/C16H11N2.C13H12FN2.C12H8F2NO.C12H8F2N.C12H9FN.C12H10O.2C5H8O2.4Ir.Pt/c1-3-10-17-15(8-1)13-6-5-7-14(12-13)16-9-2-4-11-18-16;1-15-9-10-6-7-16-13(8-10)11-2-4-12(14)5-3-11;13-9-1-2-10(11(14)6-9)12-5-8(7-16)3-4-15-12;1-8-4-5-15-12(6-8)10-3-2-9(13)7-11(10)14;1-9-6-7-14-12(8-9)10-2-4-11(13)5-3-10;13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;2*1-4(6)3-5(2)7;;;;;/h1-11H;2,4-8,15H,9H2,1H3;1,3-6,16H,7H2;2,4-7H,1H3;2,4-8H,1H3;1-9,13H;2*3,6H,1-2H3;;;;;/q5*-1
• InChIKey: FNUREWMFAUYUIU-UHFFFAOYSA-N
• XLogP: 19.59
• TPSA: 204.43 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 13
• Rotatable Bonds: 12
• Heavy Atoms: 111
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2391.53
LogP ≤ 5	19.59
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	13

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-difluorobenzene-6-id-1-yl)-4-methylpyridine;[2-(2,4-difluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;2-(4-fluorobenzene-6-id-1-yl)-4-methylpyridine;1-[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]-N-methylmethanamine;bis(4-hydroxypent-3-en-2-one);tetrakis(iridium);2-phenylphenol;platinum;2-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine?

The IUPAC name of 2-(2,4-difluorobenzene-6-id-1-yl)-4-methylpyridine;[2-(2,4-difluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;2-(4-fluorobenzene-6-id-1-yl)-4-methylpyridine;1-[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]-N-methylmethanamine;bis(4-hydroxypent-3-en-2-one);tetrakis(iridium);2-phenylphenol;platinum;2-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine (CID 161413848) is 2-(2,4-difluorobenzene-6-id-1-yl)-4-methylpyridine;[2-(2,4-difluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;2-(4-fluorobenzene-6-id-1-yl)-4-methylpyridine;1-[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]-N-methylmethanamine;bis(4-hydroxypent-3-en-2-one);tetrakis(iridium);2-phenylphenol;platinum;2-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine.

What is the SMILES notation for 2-(2,4-difluorobenzene-6-id-1-yl)-4-methylpyridine;[2-(2,4-difluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;2-(4-fluorobenzene-6-id-1-yl)-4-methylpyridine;1-[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]-N-methylmethanamine;bis(4-hydroxypent-3-en-2-one);tetrakis(iridium);2-phenylphenol;platinum;2-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine?

The canonical SMILES for 2-(2,4-difluorobenzene-6-id-1-yl)-4-methylpyridine;[2-(2,4-difluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;2-(4-fluorobenzene-6-id-1-yl)-4-methylpyridine;1-[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]-N-methylmethanamine;bis(4-hydroxypent-3-en-2-one);tetrakis(iridium);2-phenylphenol;platinum;2-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine is CC(=O)C=C(C)O.CC(=O)C=C(C)O.CNCc1ccnc(-c2[c-]cc(F)cc2)c1.Cc1ccnc(-c2[c-]cc(F)cc2)c1.Cc1ccnc(-c2[c-]cc(F)cc2F)c1.OCc1ccnc(-c2[c-]cc(F)cc2F)c1.Oc1ccccc1-c1ccccc1.[Ir].[Ir].[Ir].[Ir].[Pt].[c-]1c(-c2ccccn2)cccc1-c1ccccn1.

What is the InChIKey of 2-(2,4-difluorobenzene-6-id-1-yl)-4-methylpyridine;[2-(2,4-difluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;2-(4-fluorobenzene-6-id-1-yl)-4-methylpyridine;1-[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]-N-methylmethanamine;bis(4-hydroxypent-3-en-2-one);tetrakis(iridium);2-phenylphenol;platinum;2-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine?

The InChIKey is FNUREWMFAUYUIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11N2.C13H12FN2.C12H8F2NO.C12H8F2N.C12H9FN.C12H10O.2C5H8O2.4Ir.Pt/c1-3-10-17-15(8-1)13-6-5-7-14(12-13)16-9-2-4-11-18-16;1-15-9-10-6-7-16-13(8-10)11-2-4-12(14)5-3-11;13-9-1-2-10(11(14)6-9)12-5-8(7-16)3-4-15-12;1-8-4-5-15-12(6-8)10-3-2-9(13)7-11(10)14;1-9-6-7-14-12(8-9)10-2-4-11(13)5-3-10;13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;2*1-4(6)3-5(2)7;;;;;/h1-11H;2,4-8,15H,9H2,1H3;1,3-6,16H,7H2;2,4-7H,1H3;2,4-8H,1H3;1-9,13H;2*3,6H,1-2H3;;;;;/q5*-1;;;;;;;;.

What are the key properties of 2-(2,4-difluorobenzene-6-id-1-yl)-4-methylpyridine;[2-(2,4-difluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;2-(4-fluorobenzene-6-id-1-yl)-4-methylpyridine;1-[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]-N-methylmethanamine;bis(4-hydroxypent-3-en-2-one);tetrakis(iridium);2-phenylphenol;platinum;2-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine?

2-(2,4-difluorobenzene-6-id-1-yl)-4-methylpyridine;[2-(2,4-difluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;2-(4-fluorobenzene-6-id-1-yl)-4-methylpyridine;1-[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]-N-methylmethanamine;bis(4-hydroxypent-3-en-2-one);tetrakis(iridium);2-phenylphenol;platinum;2-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine has a molecular weight of 2391.53 g/mol, XLogP of 19.59, 12 rotatable bonds, 5 hydrogen bond donors, and 13 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(2,4-difluorobenzene-6-id-1-yl)-4-methylpyridine;[2-(2,4-difluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;2-(4-fluorobenzene-6-id-1-yl)-4-methylpyridine;1-[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]-N-methylmethanamine;bis(4-hydroxypent-3-en-2-one);tetrakis(iridium);2-phenylphenol;platinum;2-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine is sourced from PubChem (CID 161413848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).