N,N'-bis[2-(dimethylamino)ethyl]ethanediimidate;bis(4-methyl-2-(4-methyl-2-pyridinyl)pyridine);bis(nickel(2+));diperchlorate

C34H44Cl2N8Ni2O10 — CID 139060080

About N,N'-bis[2-(dimethylamino)ethyl]ethanediimidate;bis(4-methyl-2-(4-methyl-2-pyridinyl)pyridine);bis(nickel(2+));diperchlorate

N,N'-bis[2-(dimethylamino)ethyl]ethanediimidate;bis(4-methyl-2-(4-methyl-2-pyridinyl)pyridine);bis(nickel(2+));diperchlorate (PubChem CID 139060080) has the molecular formula C34H44Cl2N8Ni2O10 and a molecular weight of 913.06 g/mol. Its IUPAC name is N,N'-bis[2-(dimethylamino)ethyl]ethanediimidate;bis(4-methyl-2-(4-methyl-2-pyridinyl)pyridine);bis(nickel(2+));diperchlorate.

Molecular Properties

• Compound Name: N,N'-bis[2-(dimethylamino)ethyl]ethanediimidate;bis(4-methyl-2-(4-methyl-2-pyridinyl)pyridine);bis(nickel(2+));diperchlorate
• PubChem CID: 139060080
• Molecular Formula: C34H44Cl2N8Ni2O10
• Molecular Weight: 913.06 g/mol
• Exact Mass: 910.13
• IUPAC Name: N,N'-bis[2-(dimethylamino)ethyl]ethanediimidate;bis(4-methyl-2-(4-methyl-2-pyridinyl)pyridine);bis(nickel(2+));diperchlorate
• SMILES: CN(C)CC/N=C([O-])/C([O-])=N/CCN(C)C.Cc1ccnc(-c2cc(C)ccn2)c1.Cc1ccnc(-c2cc(C)ccn2)c1.[Ni+2].[Ni+2].[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-]
• InChI: InChI=1S/2C12H12N2.C10H22N4O2.2ClHO4.2Ni/c2*1-9-3-5-13-11(7-9)12-8-10(2)4-6-14-12;1-13(2)7-5-11-9(15)10(16)12-6-8-14(3)4;2*2-1(3,4)5;;/h2*3-8H,1-2H3;5-8H2,1-4H3,(H,11,15)(H,12,16);2*(H,2,3,4,5);;/q;;;;;2*+2/p-4
• InChIKey: CCXLLMZTBDRYNT-UHFFFAOYSA-J
• XLogP: -6.37
• TPSA: 313.36 Ų
• H-Bond Acceptors: 18
• Rotatable Bonds: 8
• Heavy Atoms: 56
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	913.06
LogP ≤ 5	-6.37
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	18

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N,N'-bis[2-(dimethylamino)ethyl]ethanediimidate;bis(4-methyl-2-(4-methyl-2-pyridinyl)pyridine);bis(nickel(2+));diperchlorate?

The IUPAC name of N,N'-bis[2-(dimethylamino)ethyl]ethanediimidate;bis(4-methyl-2-(4-methyl-2-pyridinyl)pyridine);bis(nickel(2+));diperchlorate (CID 139060080) is N,N'-bis[2-(dimethylamino)ethyl]ethanediimidate;bis(4-methyl-2-(4-methyl-2-pyridinyl)pyridine);bis(nickel(2+));diperchlorate.

What is the SMILES notation for N,N'-bis[2-(dimethylamino)ethyl]ethanediimidate;bis(4-methyl-2-(4-methyl-2-pyridinyl)pyridine);bis(nickel(2+));diperchlorate?

The canonical SMILES for N,N'-bis[2-(dimethylamino)ethyl]ethanediimidate;bis(4-methyl-2-(4-methyl-2-pyridinyl)pyridine);bis(nickel(2+));diperchlorate is CN(C)CC/N=C([O-])/C([O-])=N/CCN(C)C.Cc1ccnc(-c2cc(C)ccn2)c1.Cc1ccnc(-c2cc(C)ccn2)c1.[Ni+2].[Ni+2].[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-].

What is the InChIKey of N,N'-bis[2-(dimethylamino)ethyl]ethanediimidate;bis(4-methyl-2-(4-methyl-2-pyridinyl)pyridine);bis(nickel(2+));diperchlorate?

The InChIKey is CCXLLMZTBDRYNT-UHFFFAOYSA-J. The full InChI is InChI=1S/2C12H12N2.C10H22N4O2.2ClHO4.2Ni/c2*1-9-3-5-13-11(7-9)12-8-10(2)4-6-14-12;1-13(2)7-5-11-9(15)10(16)12-6-8-14(3)4;2*2-1(3,4)5;;/h2*3-8H,1-2H3;5-8H2,1-4H3,(H,11,15)(H,12,16);2*(H,2,3,4,5);;/q;;;;;2*+2/p-4.

What are the key properties of N,N'-bis[2-(dimethylamino)ethyl]ethanediimidate;bis(4-methyl-2-(4-methyl-2-pyridinyl)pyridine);bis(nickel(2+));diperchlorate?

N,N'-bis[2-(dimethylamino)ethyl]ethanediimidate;bis(4-methyl-2-(4-methyl-2-pyridinyl)pyridine);bis(nickel(2+));diperchlorate has a molecular weight of 913.06 g/mol, XLogP of -6.37, 8 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for N,N'-bis[2-(dimethylamino)ethyl]ethanediimidate;bis(4-methyl-2-(4-methyl-2-pyridinyl)pyridine);bis(nickel(2+));diperchlorate is sourced from PubChem (CID 139060080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).