About 4-(4-methylphenyl)-2-pyridin-2-ylpyridine;hexakis(2-pyridin-2-ylpyridine);2-pyridin-2-yl-4-[4-(2-pyridin-2-yl-4-pyridinyl)phenyl]pyridine;2-pyridin-2-yl-4-[4-[2-[4-[4-(2-pyridin-2-yl-4-pyridinyl)phenyl]-2-pyridinyl]-4-pyridinyl]phenyl]pyridine;ruthenium
4-(4-methylphenyl)-2-pyridin-2-ylpyridine;hexakis(2-pyridin-2-ylpyridine);2-pyridin-2-yl-4-[4-(2-pyridin-2-yl-4-pyridinyl)phenyl]pyridine;2-pyridin-2-yl-4-[4-[2-[4-[4-(2-pyridin-2-yl-4-pyridinyl)phenyl]-2-pyridinyl]-4-pyridinyl]phenyl]pyridine;ruthenium (PubChem CID 59411955) has the molecular formula C145H108N24Ru4
and a molecular weight of 2590.91 g/mol. Its IUPAC name is 4-(4-methylphenyl)-2-pyridin-2-ylpyridine;hexakis(2-pyridin-2-ylpyridine);2-pyridin-2-yl-4-[4-(2-pyridin-2-yl-4-pyridinyl)phenyl]pyridine;2-pyridin-2-yl-4-[4-[2-[4-[4-(2-pyridin-2-yl-4-pyridinyl)phenyl]-2-pyridinyl]-4-pyridinyl]phenyl]pyridine;ruthenium.
Molecular Properties
| Compound Name | 4-(4-methylphenyl)-2-pyridin-2-ylpyridine;hexakis(2-pyridin-2-ylpyridine);2-pyridin-2-yl-4-[4-(2-pyridin-2-yl-4-pyridinyl)phenyl]pyridine;2-pyridin-2-yl-4-[4-[2-[4-[4-(2-pyridin-2-yl-4-pyridinyl)phenyl]-2-pyridinyl]-4-pyridinyl]phenyl]pyridine;ruthenium |
| PubChem CID | 59411955 |
| Molecular Formula | C145H108N24Ru4 |
| Molecular Weight | 2590.91 g/mol |
| Exact Mass | 2592.54 |
| IUPAC Name | 4-(4-methylphenyl)-2-pyridin-2-ylpyridine;hexakis(2-pyridin-2-ylpyridine);2-pyridin-2-yl-4-[4-(2-pyridin-2-yl-4-pyridinyl)phenyl]pyridine;2-pyridin-2-yl-4-[4-[2-[4-[4-(2-pyridin-2-yl-4-pyridinyl)phenyl]-2-pyridinyl]-4-pyridinyl]phenyl]pyridine;ruthenium |
| SMILES | Cc1ccc(-c2ccnc(-c3ccccn3)c2)cc1.[Ru].[Ru].[Ru].[Ru].c1ccc(-c2cc(-c3ccc(-c4ccnc(-c5cc(-c6ccc(-c7ccnc(-c8ccccn8)c7)cc6)ccn5)c4)cc3)ccn2)nc1.c1ccc(-c2cc(-c3ccc(-c4ccnc(-c5ccccn5)c4)cc3)ccn2)nc1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1 |
| InChI | InChI=1S/C42H28N6.C26H18N4.C17H14N2.6C10H8N2.4Ru/c1-3-19-43-37(5-1)39-25-33(15-21-45-39)29-7-11-31(12-8-29)35-17-23-47-41(27-35)42-28-36(18-24-48-42)32-13-9-30(10-14-32)34-16-22-46-40(26-34)38-6-2-4-20-44-38;1-3-13-27-23(5-1)25-17-21(11-15-29-25)19-7-9-20(10-8-19)22-12-16-30-26(18-22)24-6-2-4-14-28-24;1-13-5-7-14(8-6-13)15-9-11-19-17(12-15)16-4-2-3-10-18-16;6*1-3-7-11-9(5-1)10-6-2-4-8-12-10;;;;/h1-28H;1-18H;2-12H,1H3;6*1-8H;;;; |
| InChIKey | BLEZOFLEXFYNJC-UHFFFAOYSA-N |
| XLogP | 32.63 |
| TPSA | 309.36 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 24 |
| Rotatable Bonds | 19 |
| Heavy Atoms | 173 |
| Complexity | — |
Lipinski Rule of Five
3 violations
| Rule | Value |
| MW ≤ 500 | 2590.91 |
| LogP ≤ 5 | 32.63 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 24 |
Analyze 4-(4-methylphenyl)-2-pyridin-2-ylpyridine;hexakis(2-pyridin-2-ylpyridine);2-pyridin-2-yl-4-[4-(2-pyridin-2-yl-4-pyridinyl)phenyl]pyridine;2-pyridin-2-yl-4-[4-[2-[4-[4-(2-pyridin-2-yl-4-pyridinyl)phenyl]-2-pyridinyl]-4-pyridinyl]phenyl]pyridine;ruthenium with MolForge
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Frequently Asked Questions
What is the IUPAC name of 4-(4-methylphenyl)-2-pyridin-2-ylpyridine;hexakis(2-pyridin-2-ylpyridine);2-pyridin-2-yl-4-[4-(2-pyridin-2-yl-4-pyridinyl)phenyl]pyridine;2-pyridin-2-yl-4-[4-[2-[4-[4-(2-pyridin-2-yl-4-pyridinyl)phenyl]-2-pyridinyl]-4-pyridinyl]phenyl]pyridine;ruthenium?
The IUPAC name of 4-(4-methylphenyl)-2-pyridin-2-ylpyridine;hexakis(2-pyridin-2-ylpyridine);2-pyridin-2-yl-4-[4-(2-pyridin-2-yl-4-pyridinyl)phenyl]pyridine;2-pyridin-2-yl-4-[4-[2-[4-[4-(2-pyridin-2-yl-4-pyridinyl)phenyl]-2-pyridinyl]-4-pyridinyl]phenyl]pyridine;ruthenium (CID 59411955) is 4-(4-methylphenyl)-2-pyridin-2-ylpyridine;hexakis(2-pyridin-2-ylpyridine);2-pyridin-2-yl-4-[4-(2-pyridin-2-yl-4-pyridinyl)phenyl]pyridine;2-pyridin-2-yl-4-[4-[2-[4-[4-(2-pyridin-2-yl-4-pyridinyl)phenyl]-2-pyridinyl]-4-pyridinyl]phenyl]pyridine;ruthenium.
What is the SMILES notation for 4-(4-methylphenyl)-2-pyridin-2-ylpyridine;hexakis(2-pyridin-2-ylpyridine);2-pyridin-2-yl-4-[4-(2-pyridin-2-yl-4-pyridinyl)phenyl]pyridine;2-pyridin-2-yl-4-[4-[2-[4-[4-(2-pyridin-2-yl-4-pyridinyl)phenyl]-2-pyridinyl]-4-pyridinyl]phenyl]pyridine;ruthenium?
The canonical SMILES for 4-(4-methylphenyl)-2-pyridin-2-ylpyridine;hexakis(2-pyridin-2-ylpyridine);2-pyridin-2-yl-4-[4-(2-pyridin-2-yl-4-pyridinyl)phenyl]pyridine;2-pyridin-2-yl-4-[4-[2-[4-[4-(2-pyridin-2-yl-4-pyridinyl)phenyl]-2-pyridinyl]-4-pyridinyl]phenyl]pyridine;ruthenium is Cc1ccc(-c2ccnc(-c3ccccn3)c2)cc1.[Ru].[Ru].[Ru].[Ru].c1ccc(-c2cc(-c3ccc(-c4ccnc(-c5cc(-c6ccc(-c7ccnc(-c8ccccn8)c7)cc6)ccn5)c4)cc3)ccn2)nc1.c1ccc(-c2cc(-c3ccc(-c4ccnc(-c5ccccn5)c4)cc3)ccn2)nc1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.
What is the InChIKey of 4-(4-methylphenyl)-2-pyridin-2-ylpyridine;hexakis(2-pyridin-2-ylpyridine);2-pyridin-2-yl-4-[4-(2-pyridin-2-yl-4-pyridinyl)phenyl]pyridine;2-pyridin-2-yl-4-[4-[2-[4-[4-(2-pyridin-2-yl-4-pyridinyl)phenyl]-2-pyridinyl]-4-pyridinyl]phenyl]pyridine;ruthenium?
The InChIKey is BLEZOFLEXFYNJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H28N6.C26H18N4.C17H14N2.6C10H8N2.4Ru/c1-3-19-43-37(5-1)39-25-33(15-21-45-39)29-7-11-31(12-8-29)35-17-23-47-41(27-35)42-28-36(18-24-48-42)32-13-9-30(10-14-32)34-16-22-46-40(26-34)38-6-2-4-20-44-38;1-3-13-27-23(5-1)25-17-21(11-15-29-25)19-7-9-20(10-8-19)22-12-16-30-26(18-22)24-6-2-4-14-28-24;1-13-5-7-14(8-6-13)15-9-11-19-17(12-15)16-4-2-3-10-18-16;6*1-3-7-11-9(5-1)10-6-2-4-8-12-10;;;;/h1-28H;1-18H;2-12H,1H3;6*1-8H;;;;.
What are the key properties of 4-(4-methylphenyl)-2-pyridin-2-ylpyridine;hexakis(2-pyridin-2-ylpyridine);2-pyridin-2-yl-4-[4-(2-pyridin-2-yl-4-pyridinyl)phenyl]pyridine;2-pyridin-2-yl-4-[4-[2-[4-[4-(2-pyridin-2-yl-4-pyridinyl)phenyl]-2-pyridinyl]-4-pyridinyl]phenyl]pyridine;ruthenium?
4-(4-methylphenyl)-2-pyridin-2-ylpyridine;hexakis(2-pyridin-2-ylpyridine);2-pyridin-2-yl-4-[4-(2-pyridin-2-yl-4-pyridinyl)phenyl]pyridine;2-pyridin-2-yl-4-[4-[2-[4-[4-(2-pyridin-2-yl-4-pyridinyl)phenyl]-2-pyridinyl]-4-pyridinyl]phenyl]pyridine;ruthenium has a molecular weight of 2590.91 g/mol, XLogP of 32.63, 19 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methylphenyl)-2-pyridin-2-ylpyridine;hexakis(2-pyridin-2-ylpyridine);2-pyridin-2-yl-4-[4-(2-pyridin-2-yl-4-pyridinyl)phenyl]pyridine;2-pyridin-2-yl-4-[4-[2-[4-[4-(2-pyridin-2-yl-4-pyridinyl)phenyl]-2-pyridinyl]-4-pyridinyl]phenyl]pyridine;ruthenium is sourced from PubChem (CID 59411955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).