4-methoxy-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;4-methoxy-2-(2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(2-octoxybenzene-6-id-1-yl)pyridine;tetrakis(osmium(1+))

C82H108N4O6Os4 — CID 157456131

IUPAC4-methoxy-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;4-methoxy-2-(2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(2-octoxybenzene-6-id-1-yl)pyridine;tetrakis(osmium(1+))
SMILESCCCCCCCCOc1c(-c2cc(OC)ccn2)[c-]ccc1C.CCCCCCCCOc1c(-c2ncccc2C)[c-]ccc1C.CCCCCCCCOc1ccc[c-]c1-c1cc(OC)ccn1.CCCCCCCCOc1ccc[c-]c1-c1ncccc1C.[Os+].[Os+].[Os+].[Os+]
InChIInChI=1S/C21H28NO2.C21H28NO.C20H26NO2.C20H26NO.4Os/c1-4-5-6-7-8-9-15-24-21-17(2)11-10-12-19(21)20-16-18(23-3)13-14-22-20;1-4-5-6-7-8-9-16-23-21-18(3)12-10-14-19(21)20-17(2)13-11-15-22-20;1-3-4-5-6-7-10-15-23-20-12-9-8-11-18(20)19-16-17(22-2)13-14-21-19;1-3-4-5-6-7-10-16-22-19-14-9-8-13-18(19)20-17(2)12-11-15-21-20;;;;/h10-11,13-14,16H,4-9,15H2,1-3H3;10-13,15H,4-9,16H2,1-3H3;8-9,12-14,16H,3-7,10,15H2,1-2H3;8-9,11-12,14-15H,3-7,10,16H2,1-2H3;;;;/q4*-1;4*+1
InChIKeyHHSYKLDCNKSYDK-UHFFFAOYSA-N
MW2006.71 g/mol
LogP22.39
Rot. Bonds38

About 4-methoxy-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;4-methoxy-2-(2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(2-octoxybenzene-6-id-1-yl)pyridine;tetrakis(osmium(1+))

4-methoxy-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;4-methoxy-2-(2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(2-octoxybenzene-6-id-1-yl)pyridine;tetrakis(osmium(1+)) (PubChem CID 157456131) has the molecular formula C82H108N4O6Os4 and a molecular weight of 2006.71 g/mol. Its IUPAC name is 4-methoxy-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;4-methoxy-2-(2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(2-octoxybenzene-6-id-1-yl)pyridine;tetrakis(osmium(1+)).

Molecular Properties

Compound Name4-methoxy-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;4-methoxy-2-(2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(2-octoxybenzene-6-id-1-yl)pyridine;tetrakis(osmium(1+))
PubChem CID157456131
Molecular FormulaC82H108N4O6Os4
Molecular Weight2006.71 g/mol
Exact Mass2012.67
IUPAC Name4-methoxy-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;4-methoxy-2-(2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(2-octoxybenzene-6-id-1-yl)pyridine;tetrakis(osmium(1+))
SMILESCCCCCCCCOc1c(-c2cc(OC)ccn2)[c-]ccc1C.CCCCCCCCOc1c(-c2ncccc2C)[c-]ccc1C.CCCCCCCCOc1ccc[c-]c1-c1cc(OC)ccn1.CCCCCCCCOc1ccc[c-]c1-c1ncccc1C.[Os+].[Os+].[Os+].[Os+]
InChIInChI=1S/C21H28NO2.C21H28NO.C20H26NO2.C20H26NO.4Os/c1-4-5-6-7-8-9-15-24-21-17(2)11-10-12-19(21)20-16-18(23-3)13-14-22-20;1-4-5-6-7-8-9-16-23-21-18(3)12-10-14-19(21)20-17(2)13-11-15-22-20;1-3-4-5-6-7-10-15-23-20-12-9-8-11-18(20)19-16-17(22-2)13-14-21-19;1-3-4-5-6-7-10-16-22-19-14-9-8-13-18(19)20-17(2)12-11-15-21-20;;;;/h10-11,13-14,16H,4-9,15H2,1-3H3;10-13,15H,4-9,16H2,1-3H3;8-9,12-14,16H,3-7,10,15H2,1-2H3;8-9,11-12,14-15H,3-7,10,16H2,1-2H3;;;;/q4*-1;4*+1
InChIKeyHHSYKLDCNKSYDK-UHFFFAOYSA-N
XLogP22.39
TPSA106.94 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds38
Heavy Atoms96
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002006.71
LogP ≤ 522.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;4-methoxy-2-(2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(2-octoxybenzene-6-id-1-yl)pyridine;tetrakis(osmium(1+))?
The IUPAC name of 4-methoxy-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;4-methoxy-2-(2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(2-octoxybenzene-6-id-1-yl)pyridine;tetrakis(osmium(1+)) (CID 157456131) is 4-methoxy-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;4-methoxy-2-(2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(2-octoxybenzene-6-id-1-yl)pyridine;tetrakis(osmium(1+)).
What is the SMILES notation for 4-methoxy-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;4-methoxy-2-(2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(2-octoxybenzene-6-id-1-yl)pyridine;tetrakis(osmium(1+))?
The canonical SMILES for 4-methoxy-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;4-methoxy-2-(2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(2-octoxybenzene-6-id-1-yl)pyridine;tetrakis(osmium(1+)) is CCCCCCCCOc1c(-c2cc(OC)ccn2)[c-]ccc1C.CCCCCCCCOc1c(-c2ncccc2C)[c-]ccc1C.CCCCCCCCOc1ccc[c-]c1-c1cc(OC)ccn1.CCCCCCCCOc1ccc[c-]c1-c1ncccc1C.[Os+].[Os+].[Os+].[Os+].
What is the InChIKey of 4-methoxy-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;4-methoxy-2-(2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(2-octoxybenzene-6-id-1-yl)pyridine;tetrakis(osmium(1+))?
The InChIKey is HHSYKLDCNKSYDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H28NO2.C21H28NO.C20H26NO2.C20H26NO.4Os/c1-4-5-6-7-8-9-15-24-21-17(2)11-10-12-19(21)20-16-18(23-3)13-14-22-20;1-4-5-6-7-8-9-16-23-21-18(3)12-10-14-19(21)20-17(2)13-11-15-22-20;1-3-4-5-6-7-10-15-23-20-12-9-8-11-18(20)19-16-17(22-2)13-14-21-19;1-3-4-5-6-7-10-16-22-19-14-9-8-13-18(19)20-17(2)12-11-15-21-20;;;;/h10-11,13-14,16H,4-9,15H2,1-3H3;10-13,15H,4-9,16H2,1-3H3;8-9,12-14,16H,3-7,10,15H2,1-2H3;8-9,11-12,14-15H,3-7,10,16H2,1-2H3;;;;/q4*-1;4*+1.
What are the key properties of 4-methoxy-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;4-methoxy-2-(2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(2-octoxybenzene-6-id-1-yl)pyridine;tetrakis(osmium(1+))?
4-methoxy-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;4-methoxy-2-(2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(2-octoxybenzene-6-id-1-yl)pyridine;tetrakis(osmium(1+)) has a molecular weight of 2006.71 g/mol, XLogP of 22.39, 38 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;4-methoxy-2-(2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(2-octoxybenzene-6-id-1-yl)pyridine;tetrakis(osmium(1+)) is sourced from PubChem (CID 157456131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).