2-(4-acetyl-2-pyridinyl)pyridine-4-carbaldehyde;ethane;methyl 2-(4-formyl-2-pyridinyl)pyridine-4-carboxylate;bis(2-pyridin-2-ylpyridine);2-pyrimidin-2-ylpyrimidine;ruthenium

C56H48N12O5Ru2 — CID 143210249

About 2-(4-acetyl-2-pyridinyl)pyridine-4-carbaldehyde;ethane;methyl 2-(4-formyl-2-pyridinyl)pyridine-4-carboxylate;bis(2-pyridin-2-ylpyridine);2-pyrimidin-2-ylpyrimidine;ruthenium

2-(4-acetyl-2-pyridinyl)pyridine-4-carbaldehyde;ethane;methyl 2-(4-formyl-2-pyridinyl)pyridine-4-carboxylate;bis(2-pyridin-2-ylpyridine);2-pyrimidin-2-ylpyrimidine;ruthenium (PubChem CID 143210249) has the molecular formula C56H48N12O5Ru2 and a molecular weight of 1171.22 g/mol. Its IUPAC name is 2-(4-acetyl-2-pyridinyl)pyridine-4-carbaldehyde;ethane;methyl 2-(4-formyl-2-pyridinyl)pyridine-4-carboxylate;bis(2-pyridin-2-ylpyridine);2-pyrimidin-2-ylpyrimidine;ruthenium.

Molecular Properties

• Compound Name: 2-(4-acetyl-2-pyridinyl)pyridine-4-carbaldehyde;ethane;methyl 2-(4-formyl-2-pyridinyl)pyridine-4-carboxylate;bis(2-pyridin-2-ylpyridine);2-pyrimidin-2-ylpyrimidine;ruthenium
• PubChem CID: 143210249
• Molecular Formula: C56H48N12O5Ru2
• Molecular Weight: 1171.22 g/mol
• Exact Mass: 1172.20
• IUPAC Name: 2-(4-acetyl-2-pyridinyl)pyridine-4-carbaldehyde;ethane;methyl 2-(4-formyl-2-pyridinyl)pyridine-4-carboxylate;bis(2-pyridin-2-ylpyridine);2-pyrimidin-2-ylpyrimidine;ruthenium
• SMILES: CC.CC(=O)c1ccnc(-c2cc(C=O)ccn2)c1.COC(=O)c1ccnc(-c2cc(C=O)ccn2)c1.[Ru].[Ru].c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1cnc(-c2ncccn2)nc1
• InChI: InChI=1S/C13H10N2O3.C13H10N2O2.2C10H8N2.C8H6N4.C2H6.2Ru/c1-18-13(17)10-3-5-15-12(7-10)11-6-9(8-16)2-4-14-11;1-9(17)11-3-5-15-13(7-11)12-6-10(8-16)2-4-14-12;2*1-3-7-11-9(5-1)10-6-2-4-8-12-10;1-3-9-7(10-4-1)8-11-5-2-6-12-8;1-2;;/h2-8H,1H3;2-8H,1H3;2*1-8H;1-6H;1-2H3
• InChIKey: XCVVLSYWFZKYSR-UHFFFAOYSA-N
• XLogP: 10.14
• TPSA: 232.19 Ų
• H-Bond Acceptors: 17
• Rotatable Bonds: 9
• Heavy Atoms: 75
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1171.22
LogP ≤ 5	10.14
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	17

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-(4-acetyl-2-pyridinyl)pyridine-4-carbaldehyde;ethane;methyl 2-(4-formyl-2-pyridinyl)pyridine-4-carboxylate;bis(2-pyridin-2-ylpyridine);2-pyrimidin-2-ylpyrimidine;ruthenium?

The IUPAC name of 2-(4-acetyl-2-pyridinyl)pyridine-4-carbaldehyde;ethane;methyl 2-(4-formyl-2-pyridinyl)pyridine-4-carboxylate;bis(2-pyridin-2-ylpyridine);2-pyrimidin-2-ylpyrimidine;ruthenium (CID 143210249) is 2-(4-acetyl-2-pyridinyl)pyridine-4-carbaldehyde;ethane;methyl 2-(4-formyl-2-pyridinyl)pyridine-4-carboxylate;bis(2-pyridin-2-ylpyridine);2-pyrimidin-2-ylpyrimidine;ruthenium.

What is the SMILES notation for 2-(4-acetyl-2-pyridinyl)pyridine-4-carbaldehyde;ethane;methyl 2-(4-formyl-2-pyridinyl)pyridine-4-carboxylate;bis(2-pyridin-2-ylpyridine);2-pyrimidin-2-ylpyrimidine;ruthenium?

The canonical SMILES for 2-(4-acetyl-2-pyridinyl)pyridine-4-carbaldehyde;ethane;methyl 2-(4-formyl-2-pyridinyl)pyridine-4-carboxylate;bis(2-pyridin-2-ylpyridine);2-pyrimidin-2-ylpyrimidine;ruthenium is CC.CC(=O)c1ccnc(-c2cc(C=O)ccn2)c1.COC(=O)c1ccnc(-c2cc(C=O)ccn2)c1.[Ru].[Ru].c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1cnc(-c2ncccn2)nc1.

What is the InChIKey of 2-(4-acetyl-2-pyridinyl)pyridine-4-carbaldehyde;ethane;methyl 2-(4-formyl-2-pyridinyl)pyridine-4-carboxylate;bis(2-pyridin-2-ylpyridine);2-pyrimidin-2-ylpyrimidine;ruthenium?

The InChIKey is XCVVLSYWFZKYSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N2O3.C13H10N2O2.2C10H8N2.C8H6N4.C2H6.2Ru/c1-18-13(17)10-3-5-15-12(7-10)11-6-9(8-16)2-4-14-11;1-9(17)11-3-5-15-13(7-11)12-6-10(8-16)2-4-14-12;2*1-3-7-11-9(5-1)10-6-2-4-8-12-10;1-3-9-7(10-4-1)8-11-5-2-6-12-8;1-2;;/h2-8H,1H3;2-8H,1H3;2*1-8H;1-6H;1-2H3;;.

What are the key properties of 2-(4-acetyl-2-pyridinyl)pyridine-4-carbaldehyde;ethane;methyl 2-(4-formyl-2-pyridinyl)pyridine-4-carboxylate;bis(2-pyridin-2-ylpyridine);2-pyrimidin-2-ylpyrimidine;ruthenium?

2-(4-acetyl-2-pyridinyl)pyridine-4-carbaldehyde;ethane;methyl 2-(4-formyl-2-pyridinyl)pyridine-4-carboxylate;bis(2-pyridin-2-ylpyridine);2-pyrimidin-2-ylpyrimidine;ruthenium has a molecular weight of 1171.22 g/mol, XLogP of 10.14, 9 rotatable bonds, 0 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(4-acetyl-2-pyridinyl)pyridine-4-carbaldehyde;ethane;methyl 2-(4-formyl-2-pyridinyl)pyridine-4-carboxylate;bis(2-pyridin-2-ylpyridine);2-pyrimidin-2-ylpyrimidine;ruthenium is sourced from PubChem (CID 143210249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).