[2-(1H-imidazo[4,5-f][1,10]phenanthrolin-2-yl)phenyl]methanol;methane;2-(3-methylphenyl)-1H-imidazo[4,5-f][1,10]phenanthroline;bis(2-(4-methylphenyl)-1H-imidazo[4,5-f][1,10]phenanthroline);11-methylquinoxalino[2,3-f][1,10]phenanthroline;octakis(1,10-phenanthroline);hexakis(2-pyridin-2-ylpyridine);bis(quinoxalino[2,3-f][1,10]phenanthroline);ruthenium

C292H204N56ORu7 — CID 162177189

IUPAC[2-(1H-imidazo[4,5-f][1,10]phenanthrolin-2-yl)phenyl]methanol;methane;2-(3-methylphenyl)-1H-imidazo[4,5-f][1,10]phenanthroline;bis(2-(4-methylphenyl)-1H-imidazo[4,5-f][1,10]phenanthroline);11-methylquinoxalino[2,3-f][1,10]phenanthroline;octakis(1,10-phenanthroline);hexakis(2-pyridin-2-ylpyridine);bis(quinoxalino[2,3-f][1,10]phenanthroline);ruthenium
SMILESC.Cc1ccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)cc1.Cc1ccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)cc1.Cc1ccc2nc3c4cccnc4c4ncccc4c3nc2c1.Cc1cccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)c1.OCc1ccccc1-c1nc2c3cccnc3c3ncccc3c2[nH]1.[Ru].[Ru].[Ru].[Ru].[Ru].[Ru].[Ru].c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1ccc2nc3c4cccnc4c4ncccc4c3nc2c1.c1ccc2nc3c4cccnc4c4ncccc4c3nc2c1.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12
InChIInChI=1S/C20H14N4O.3C20H14N4.C19H12N4.2C18H10N4.8C12H8N2.6C10H8N2.CH4.7Ru/c25-11-12-5-1-2-6-13(12)20-23-18-14-7-3-9-21-16(14)17-15(19(18)24-20)8-4-10-22-17;1-12-5-2-6-13(11-12)20-23-18-14-7-3-9-21-16(14)17-15(19(18)24-20)8-4-10-22-17;2*1-12-6-8-13(9-7-12)20-23-18-14-4-2-10-21-16(14)17-15(19(18)24-20)5-3-11-22-17;1-11-6-7-14-15(10-11)23-19-13-5-3-9-21-17(13)16-12(18(19)22-14)4-2-8-20-16;2*1-2-8-14-13(7-1)21-17-11-5-3-9-19-15(11)16-12(18(17)22-14)6-4-10-20-16;8*1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;6*1-3-7-11-9(5-1)10-6-2-4-8-12-10;;;;;;;;/h1-10,25H,11H2,(H,23,24);3*2-11H,1H3,(H,23,24);2-10H,1H3;2*1-10H;8*1-8H;6*1-8H;1H4;;;;;;;
InChIKeyZONQWHJMHUUALI-UHFFFAOYSA-N
MW5220.73 g/mol
LogP65.41
Rot. Bonds11

About [2-(1H-imidazo[4,5-f][1,10]phenanthrolin-2-yl)phenyl]methanol;methane;2-(3-methylphenyl)-1H-imidazo[4,5-f][1,10]phenanthroline;bis(2-(4-methylphenyl)-1H-imidazo[4,5-f][1,10]phenanthroline);11-methylquinoxalino[2,3-f][1,10]phenanthroline;octakis(1,10-phenanthroline);hexakis(2-pyridin-2-ylpyridine);bis(quinoxalino[2,3-f][1,10]phenanthroline);ruthenium

[2-(1H-imidazo[4,5-f][1,10]phenanthrolin-2-yl)phenyl]methanol;methane;2-(3-methylphenyl)-1H-imidazo[4,5-f][1,10]phenanthroline;bis(2-(4-methylphenyl)-1H-imidazo[4,5-f][1,10]phenanthroline);11-methylquinoxalino[2,3-f][1,10]phenanthroline;octakis(1,10-phenanthroline);hexakis(2-pyridin-2-ylpyridine);bis(quinoxalino[2,3-f][1,10]phenanthroline);ruthenium (PubChem CID 162177189) has the molecular formula C292H204N56ORu7 and a molecular weight of 5220.73 g/mol. Its IUPAC name is [2-(1H-imidazo[4,5-f][1,10]phenanthrolin-2-yl)phenyl]methanol;methane;2-(3-methylphenyl)-1H-imidazo[4,5-f][1,10]phenanthroline;bis(2-(4-methylphenyl)-1H-imidazo[4,5-f][1,10]phenanthroline);11-methylquinoxalino[2,3-f][1,10]phenanthroline;octakis(1,10-phenanthroline);hexakis(2-pyridin-2-ylpyridine);bis(quinoxalino[2,3-f][1,10]phenanthroline);ruthenium.

Molecular Properties

Compound Name[2-(1H-imidazo[4,5-f][1,10]phenanthrolin-2-yl)phenyl]methanol;methane;2-(3-methylphenyl)-1H-imidazo[4,5-f][1,10]phenanthroline;bis(2-(4-methylphenyl)-1H-imidazo[4,5-f][1,10]phenanthroline);11-methylquinoxalino[2,3-f][1,10]phenanthroline;octakis(1,10-phenanthroline);hexakis(2-pyridin-2-ylpyridine);bis(quinoxalino[2,3-f][1,10]phenanthroline);ruthenium
PubChem CID162177189
Molecular FormulaC292H204N56ORu7
Molecular Weight5220.73 g/mol
Exact Mass5223.09
IUPAC Name[2-(1H-imidazo[4,5-f][1,10]phenanthrolin-2-yl)phenyl]methanol;methane;2-(3-methylphenyl)-1H-imidazo[4,5-f][1,10]phenanthroline;bis(2-(4-methylphenyl)-1H-imidazo[4,5-f][1,10]phenanthroline);11-methylquinoxalino[2,3-f][1,10]phenanthroline;octakis(1,10-phenanthroline);hexakis(2-pyridin-2-ylpyridine);bis(quinoxalino[2,3-f][1,10]phenanthroline);ruthenium
SMILESC.Cc1ccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)cc1.Cc1ccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)cc1.Cc1ccc2nc3c4cccnc4c4ncccc4c3nc2c1.Cc1cccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)c1.OCc1ccccc1-c1nc2c3cccnc3c3ncccc3c2[nH]1.[Ru].[Ru].[Ru].[Ru].[Ru].[Ru].[Ru].c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1ccc2nc3c4cccnc4c4ncccc4c3nc2c1.c1ccc2nc3c4cccnc4c4ncccc4c3nc2c1.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12
InChIInChI=1S/C20H14N4O.3C20H14N4.C19H12N4.2C18H10N4.8C12H8N2.6C10H8N2.CH4.7Ru/c25-11-12-5-1-2-6-13(12)20-23-18-14-7-3-9-21-16(14)17-15(19(18)24-20)8-4-10-22-17;1-12-5-2-6-13(11-12)20-23-18-14-7-3-9-21-16(14)17-15(19(18)24-20)8-4-10-22-17;2*1-12-6-8-13(9-7-12)20-23-18-14-4-2-10-21-16(14)17-15(19(18)24-20)5-3-11-22-17;1-11-6-7-14-15(10-11)23-19-13-5-3-9-21-17(13)16-12(18(19)22-14)4-2-8-20-16;2*1-2-8-14-13(7-1)21-17-11-5-3-9-19-15(11)16-12(18(17)22-14)6-4-10-20-16;8*1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;6*1-3-7-11-9(5-1)10-6-2-4-8-12-10;;;;;;;;/h1-10,25H,11H2,(H,23,24);3*2-11H,1H3,(H,23,24);2-10H,1H3;2*1-10H;8*1-8H;6*1-8H;1H4;;;;;;;
InChIKeyZONQWHJMHUUALI-UHFFFAOYSA-N
XLogP65.41
TPSA753.67 Ų
H-Bond Donors5
H-Bond Acceptors53
Rotatable Bonds11
Heavy Atoms356
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005220.73
LogP ≤ 565.41
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1053

Analyze [2-(1H-imidazo[4,5-f][1,10]phenanthrolin-2-yl)phenyl]methanol;methane;2-(3-methylphenyl)-1H-imidazo[4,5-f][1,10]phenanthroline;bis(2-(4-methylphenyl)-1H-imidazo[4,5-f][1,10]phenanthroline);11-methylquinoxalino[2,3-f][1,10]phenanthroline;octakis(1,10-phenanthroline);hexakis(2-pyridin-2-ylpyridine);bis(quinoxalino[2,3-f][1,10]phenanthroline);ruthenium with MolForge

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Frequently Asked Questions

What is the IUPAC name of [2-(1H-imidazo[4,5-f][1,10]phenanthrolin-2-yl)phenyl]methanol;methane;2-(3-methylphenyl)-1H-imidazo[4,5-f][1,10]phenanthroline;bis(2-(4-methylphenyl)-1H-imidazo[4,5-f][1,10]phenanthroline);11-methylquinoxalino[2,3-f][1,10]phenanthroline;octakis(1,10-phenanthroline);hexakis(2-pyridin-2-ylpyridine);bis(quinoxalino[2,3-f][1,10]phenanthroline);ruthenium?
The IUPAC name of [2-(1H-imidazo[4,5-f][1,10]phenanthrolin-2-yl)phenyl]methanol;methane;2-(3-methylphenyl)-1H-imidazo[4,5-f][1,10]phenanthroline;bis(2-(4-methylphenyl)-1H-imidazo[4,5-f][1,10]phenanthroline);11-methylquinoxalino[2,3-f][1,10]phenanthroline;octakis(1,10-phenanthroline);hexakis(2-pyridin-2-ylpyridine);bis(quinoxalino[2,3-f][1,10]phenanthroline);ruthenium (CID 162177189) is [2-(1H-imidazo[4,5-f][1,10]phenanthrolin-2-yl)phenyl]methanol;methane;2-(3-methylphenyl)-1H-imidazo[4,5-f][1,10]phenanthroline;bis(2-(4-methylphenyl)-1H-imidazo[4,5-f][1,10]phenanthroline);11-methylquinoxalino[2,3-f][1,10]phenanthroline;octakis(1,10-phenanthroline);hexakis(2-pyridin-2-ylpyridine);bis(quinoxalino[2,3-f][1,10]phenanthroline);ruthenium.
What is the SMILES notation for [2-(1H-imidazo[4,5-f][1,10]phenanthrolin-2-yl)phenyl]methanol;methane;2-(3-methylphenyl)-1H-imidazo[4,5-f][1,10]phenanthroline;bis(2-(4-methylphenyl)-1H-imidazo[4,5-f][1,10]phenanthroline);11-methylquinoxalino[2,3-f][1,10]phenanthroline;octakis(1,10-phenanthroline);hexakis(2-pyridin-2-ylpyridine);bis(quinoxalino[2,3-f][1,10]phenanthroline);ruthenium?
The canonical SMILES for [2-(1H-imidazo[4,5-f][1,10]phenanthrolin-2-yl)phenyl]methanol;methane;2-(3-methylphenyl)-1H-imidazo[4,5-f][1,10]phenanthroline;bis(2-(4-methylphenyl)-1H-imidazo[4,5-f][1,10]phenanthroline);11-methylquinoxalino[2,3-f][1,10]phenanthroline;octakis(1,10-phenanthroline);hexakis(2-pyridin-2-ylpyridine);bis(quinoxalino[2,3-f][1,10]phenanthroline);ruthenium is C.Cc1ccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)cc1.Cc1ccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)cc1.Cc1ccc2nc3c4cccnc4c4ncccc4c3nc2c1.Cc1cccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)c1.OCc1ccccc1-c1nc2c3cccnc3c3ncccc3c2[nH]1.[Ru].[Ru].[Ru].[Ru].[Ru].[Ru].[Ru].c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1ccc2nc3c4cccnc4c4ncccc4c3nc2c1.c1ccc2nc3c4cccnc4c4ncccc4c3nc2c1.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12.
What is the InChIKey of [2-(1H-imidazo[4,5-f][1,10]phenanthrolin-2-yl)phenyl]methanol;methane;2-(3-methylphenyl)-1H-imidazo[4,5-f][1,10]phenanthroline;bis(2-(4-methylphenyl)-1H-imidazo[4,5-f][1,10]phenanthroline);11-methylquinoxalino[2,3-f][1,10]phenanthroline;octakis(1,10-phenanthroline);hexakis(2-pyridin-2-ylpyridine);bis(quinoxalino[2,3-f][1,10]phenanthroline);ruthenium?
The InChIKey is ZONQWHJMHUUALI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14N4O.3C20H14N4.C19H12N4.2C18H10N4.8C12H8N2.6C10H8N2.CH4.7Ru/c25-11-12-5-1-2-6-13(12)20-23-18-14-7-3-9-21-16(14)17-15(19(18)24-20)8-4-10-22-17;1-12-5-2-6-13(11-12)20-23-18-14-7-3-9-21-16(14)17-15(19(18)24-20)8-4-10-22-17;2*1-12-6-8-13(9-7-12)20-23-18-14-4-2-10-21-16(14)17-15(19(18)24-20)5-3-11-22-17;1-11-6-7-14-15(10-11)23-19-13-5-3-9-21-17(13)16-12(18(19)22-14)4-2-8-20-16;2*1-2-8-14-13(7-1)21-17-11-5-3-9-19-15(11)16-12(18(17)22-14)6-4-10-20-16;8*1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;6*1-3-7-11-9(5-1)10-6-2-4-8-12-10;;;;;;;;/h1-10,25H,11H2,(H,23,24);3*2-11H,1H3,(H,23,24);2-10H,1H3;2*1-10H;8*1-8H;6*1-8H;1H4;;;;;;;.
What are the key properties of [2-(1H-imidazo[4,5-f][1,10]phenanthrolin-2-yl)phenyl]methanol;methane;2-(3-methylphenyl)-1H-imidazo[4,5-f][1,10]phenanthroline;bis(2-(4-methylphenyl)-1H-imidazo[4,5-f][1,10]phenanthroline);11-methylquinoxalino[2,3-f][1,10]phenanthroline;octakis(1,10-phenanthroline);hexakis(2-pyridin-2-ylpyridine);bis(quinoxalino[2,3-f][1,10]phenanthroline);ruthenium?
[2-(1H-imidazo[4,5-f][1,10]phenanthrolin-2-yl)phenyl]methanol;methane;2-(3-methylphenyl)-1H-imidazo[4,5-f][1,10]phenanthroline;bis(2-(4-methylphenyl)-1H-imidazo[4,5-f][1,10]phenanthroline);11-methylquinoxalino[2,3-f][1,10]phenanthroline;octakis(1,10-phenanthroline);hexakis(2-pyridin-2-ylpyridine);bis(quinoxalino[2,3-f][1,10]phenanthroline);ruthenium has a molecular weight of 5220.73 g/mol, XLogP of 65.41, 11 rotatable bonds, 5 hydrogen bond donors, and 53 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1H-imidazo[4,5-f][1,10]phenanthrolin-2-yl)phenyl]methanol;methane;2-(3-methylphenyl)-1H-imidazo[4,5-f][1,10]phenanthroline;bis(2-(4-methylphenyl)-1H-imidazo[4,5-f][1,10]phenanthroline);11-methylquinoxalino[2,3-f][1,10]phenanthroline;octakis(1,10-phenanthroline);hexakis(2-pyridin-2-ylpyridine);bis(quinoxalino[2,3-f][1,10]phenanthroline);ruthenium is sourced from PubChem (CID 162177189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).