2,6-bis(4H-imidazol-2-yl)pyridine;cobalt(2+);dichloride

C11H9Cl2CoN5 — CID 70012057

IUPAC2,6-bis(4H-imidazol-2-yl)pyridine;cobalt(2+);dichloride
SMILESC1=NC(c2cccc(C3=NCC=N3)n2)=NC1.[Cl-].[Cl-].[Co+2]
InChIInChI=1S/C11H9N5.2ClH.Co/c1-2-8(10-12-4-5-13-10)16-9(3-1)11-14-6-7-15-11;;;/h1-4,6H,5,7H2;2*1H;/q;;;+2/p-2
InChIKeyLJYUPTAZRZQVPN-UHFFFAOYSA-L
MW341.07 g/mol
LogP-5.25
Rot. Bonds2

About 2,6-bis(4H-imidazol-2-yl)pyridine;cobalt(2+);dichloride

2,6-bis(4H-imidazol-2-yl)pyridine;cobalt(2+);dichloride (PubChem CID 70012057) has the molecular formula C11H9Cl2CoN5 and a molecular weight of 341.07 g/mol. Its IUPAC name is 2,6-bis(4H-imidazol-2-yl)pyridine;cobalt(2+);dichloride.

Molecular Properties

Compound Name2,6-bis(4H-imidazol-2-yl)pyridine;cobalt(2+);dichloride
PubChem CID70012057
Molecular FormulaC11H9Cl2CoN5
Molecular Weight341.07 g/mol
Exact Mass339.96
IUPAC Name2,6-bis(4H-imidazol-2-yl)pyridine;cobalt(2+);dichloride
SMILESC1=NC(c2cccc(C3=NCC=N3)n2)=NC1.[Cl-].[Cl-].[Co+2]
InChIInChI=1S/C11H9N5.2ClH.Co/c1-2-8(10-12-4-5-13-10)16-9(3-1)11-14-6-7-15-11;;;/h1-4,6H,5,7H2;2*1H;/q;;;+2/p-2
InChIKeyLJYUPTAZRZQVPN-UHFFFAOYSA-L
XLogP-5.25
TPSA62.33 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.07
LogP ≤ 5-5.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2,6-bis(4H-imidazol-2-yl)pyridine;cobalt(2+);dichloride?
The IUPAC name of 2,6-bis(4H-imidazol-2-yl)pyridine;cobalt(2+);dichloride (CID 70012057) is 2,6-bis(4H-imidazol-2-yl)pyridine;cobalt(2+);dichloride.
What is the SMILES notation for 2,6-bis(4H-imidazol-2-yl)pyridine;cobalt(2+);dichloride?
The canonical SMILES for 2,6-bis(4H-imidazol-2-yl)pyridine;cobalt(2+);dichloride is C1=NC(c2cccc(C3=NCC=N3)n2)=NC1.[Cl-].[Cl-].[Co+2].
What is the InChIKey of 2,6-bis(4H-imidazol-2-yl)pyridine;cobalt(2+);dichloride?
The InChIKey is LJYUPTAZRZQVPN-UHFFFAOYSA-L. The full InChI is InChI=1S/C11H9N5.2ClH.Co/c1-2-8(10-12-4-5-13-10)16-9(3-1)11-14-6-7-15-11;;;/h1-4,6H,5,7H2;2*1H;/q;;;+2/p-2.
What are the key properties of 2,6-bis(4H-imidazol-2-yl)pyridine;cobalt(2+);dichloride?
2,6-bis(4H-imidazol-2-yl)pyridine;cobalt(2+);dichloride has a molecular weight of 341.07 g/mol, XLogP of -5.25, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-bis(4H-imidazol-2-yl)pyridine;cobalt(2+);dichloride is sourced from PubChem (CID 70012057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).