2-(4-methyl-2-pyridinyl)pyridine-4-carbaldehyde;bis(2-pyridin-2-ylpyridine);ruthenium

C32H26N6ORu — CID 139258422

IUPAC2-(4-methyl-2-pyridinyl)pyridine-4-carbaldehyde;bis(2-pyridin-2-ylpyridine);ruthenium
SMILESCc1ccnc(-c2cc(C=O)ccn2)c1.[Ru].c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1
InChIInChI=1S/C12H10N2O.2C10H8N2.Ru/c1-9-2-4-13-11(6-9)12-7-10(8-15)3-5-14-12;2*1-3-7-11-9(5-1)10-6-2-4-8-12-10;/h2-8H,1H3;2*1-8H;
InChIKeyLYCUXCZZTVWAMJ-UHFFFAOYSA-N
MW611.67 g/mol
LogP6.55
Rot. Bonds4

About 2-(4-methyl-2-pyridinyl)pyridine-4-carbaldehyde;bis(2-pyridin-2-ylpyridine);ruthenium

2-(4-methyl-2-pyridinyl)pyridine-4-carbaldehyde;bis(2-pyridin-2-ylpyridine);ruthenium (PubChem CID 139258422) has the molecular formula C32H26N6ORu and a molecular weight of 611.67 g/mol. Its IUPAC name is 2-(4-methyl-2-pyridinyl)pyridine-4-carbaldehyde;bis(2-pyridin-2-ylpyridine);ruthenium.

Molecular Properties

Compound Name2-(4-methyl-2-pyridinyl)pyridine-4-carbaldehyde;bis(2-pyridin-2-ylpyridine);ruthenium
PubChem CID139258422
Molecular FormulaC32H26N6ORu
Molecular Weight611.67 g/mol
Exact Mass612.12
IUPAC Name2-(4-methyl-2-pyridinyl)pyridine-4-carbaldehyde;bis(2-pyridin-2-ylpyridine);ruthenium
SMILESCc1ccnc(-c2cc(C=O)ccn2)c1.[Ru].c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1
InChIInChI=1S/C12H10N2O.2C10H8N2.Ru/c1-9-2-4-13-11(6-9)12-7-10(8-15)3-5-14-12;2*1-3-7-11-9(5-1)10-6-2-4-8-12-10;/h2-8H,1H3;2*1-8H;
InChIKeyLYCUXCZZTVWAMJ-UHFFFAOYSA-N
XLogP6.55
TPSA94.41 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500611.67
LogP ≤ 56.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze 2-(4-methyl-2-pyridinyl)pyridine-4-carbaldehyde;bis(2-pyridin-2-ylpyridine);ruthenium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,2'-Bipyridine-4,4'-dicarboxaldehyde
CID 4171663
4-[4-(2-Pyridin-2-ylquinolin-4-yl)piperazin-1-yl]benzaldehyde
CID 73345797
2,2'-Bipyridine-4-carboxaldehyde
CID 10171298
6-(Pyridin-2-yl)pyridine-3-carbaldehyde
CID 10866997
2-(4-Methylpyridin-2-yl)pyridine-4-carbaldehyde
CID 11193972
Ruthenium bis(bipyridine)dicarboxybipyridine
CID 3081541
(E)-3-phenyl-1-(2-pyridyl)prop-2-en-1-one; 2-(2-pyridyl)pyridine; ruthenium(2+); dihexafluorophosphate
CID 6481872
4-([2,2':6',2''-Terpyridin]-4'-yl)benzaldehyde
CID 12118587
[2,2':6',2''-Terpyridine]-4'-carbaldehyde
CID 11276986
2,2'-Bipyridyl-3,3'-dicarboxaldehyde
CID 19245638
Bipyridal
CID 82406753
2-Pyridin-2-ylquinoline-4-carbaldehyde
CID 88699429

Frequently Asked Questions

What is the IUPAC name of 2-(4-methyl-2-pyridinyl)pyridine-4-carbaldehyde;bis(2-pyridin-2-ylpyridine);ruthenium?
The IUPAC name of 2-(4-methyl-2-pyridinyl)pyridine-4-carbaldehyde;bis(2-pyridin-2-ylpyridine);ruthenium (CID 139258422) is 2-(4-methyl-2-pyridinyl)pyridine-4-carbaldehyde;bis(2-pyridin-2-ylpyridine);ruthenium.
What is the SMILES notation for 2-(4-methyl-2-pyridinyl)pyridine-4-carbaldehyde;bis(2-pyridin-2-ylpyridine);ruthenium?
The canonical SMILES for 2-(4-methyl-2-pyridinyl)pyridine-4-carbaldehyde;bis(2-pyridin-2-ylpyridine);ruthenium is Cc1ccnc(-c2cc(C=O)ccn2)c1.[Ru].c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.
What is the InChIKey of 2-(4-methyl-2-pyridinyl)pyridine-4-carbaldehyde;bis(2-pyridin-2-ylpyridine);ruthenium?
The InChIKey is LYCUXCZZTVWAMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N2O.2C10H8N2.Ru/c1-9-2-4-13-11(6-9)12-7-10(8-15)3-5-14-12;2*1-3-7-11-9(5-1)10-6-2-4-8-12-10;/h2-8H,1H3;2*1-8H;.
What are the key properties of 2-(4-methyl-2-pyridinyl)pyridine-4-carbaldehyde;bis(2-pyridin-2-ylpyridine);ruthenium?
2-(4-methyl-2-pyridinyl)pyridine-4-carbaldehyde;bis(2-pyridin-2-ylpyridine);ruthenium has a molecular weight of 611.67 g/mol, XLogP of 6.55, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methyl-2-pyridinyl)pyridine-4-carbaldehyde;bis(2-pyridin-2-ylpyridine);ruthenium is sourced from PubChem (CID 139258422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).