2,6-bis(1-ethylimidazol-2-yl)pyridine;cobalt(3+);trichloride

C15H17Cl3CoN5 — CID 70011500

IUPAC2,6-bis(1-ethylimidazol-2-yl)pyridine;cobalt(3+);trichloride
SMILESCCn1ccnc1-c1cccc(-c2nccn2CC)n1.[Cl-].[Cl-].[Cl-].[Co+3]
InChIInChI=1S/C15H17N5.3ClH.Co/c1-3-19-10-8-16-14(19)12-6-5-7-13(18-12)15-17-9-11-20(15)4-2;;;;/h5-11H,3-4H2,1-2H3;3*1H;/q;;;;+3/p-3
InChIKeyRXRZGTJRVXMSLH-UHFFFAOYSA-K
MW432.63 g/mol
LogP-6.14
Rot. Bonds4

About 2,6-bis(1-ethylimidazol-2-yl)pyridine;cobalt(3+);trichloride

2,6-bis(1-ethylimidazol-2-yl)pyridine;cobalt(3+);trichloride (PubChem CID 70011500) has the molecular formula C15H17Cl3CoN5 and a molecular weight of 432.63 g/mol. Its IUPAC name is 2,6-bis(1-ethylimidazol-2-yl)pyridine;cobalt(3+);trichloride.

Molecular Properties

Compound Name2,6-bis(1-ethylimidazol-2-yl)pyridine;cobalt(3+);trichloride
PubChem CID70011500
Molecular FormulaC15H17Cl3CoN5
Molecular Weight432.63 g/mol
Exact Mass430.99
IUPAC Name2,6-bis(1-ethylimidazol-2-yl)pyridine;cobalt(3+);trichloride
SMILESCCn1ccnc1-c1cccc(-c2nccn2CC)n1.[Cl-].[Cl-].[Cl-].[Co+3]
InChIInChI=1S/C15H17N5.3ClH.Co/c1-3-19-10-8-16-14(19)12-6-5-7-13(18-12)15-17-9-11-20(15)4-2;;;;/h5-11H,3-4H2,1-2H3;3*1H;/q;;;;+3/p-3
InChIKeyRXRZGTJRVXMSLH-UHFFFAOYSA-K
XLogP-6.14
TPSA48.53 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.63
LogP ≤ 5-6.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2,6-bis(1-ethylimidazol-2-yl)pyridine;cobalt(3+);trichloride?
The IUPAC name of 2,6-bis(1-ethylimidazol-2-yl)pyridine;cobalt(3+);trichloride (CID 70011500) is 2,6-bis(1-ethylimidazol-2-yl)pyridine;cobalt(3+);trichloride.
What is the SMILES notation for 2,6-bis(1-ethylimidazol-2-yl)pyridine;cobalt(3+);trichloride?
The canonical SMILES for 2,6-bis(1-ethylimidazol-2-yl)pyridine;cobalt(3+);trichloride is CCn1ccnc1-c1cccc(-c2nccn2CC)n1.[Cl-].[Cl-].[Cl-].[Co+3].
What is the InChIKey of 2,6-bis(1-ethylimidazol-2-yl)pyridine;cobalt(3+);trichloride?
The InChIKey is RXRZGTJRVXMSLH-UHFFFAOYSA-K. The full InChI is InChI=1S/C15H17N5.3ClH.Co/c1-3-19-10-8-16-14(19)12-6-5-7-13(18-12)15-17-9-11-20(15)4-2;;;;/h5-11H,3-4H2,1-2H3;3*1H;/q;;;;+3/p-3.
What are the key properties of 2,6-bis(1-ethylimidazol-2-yl)pyridine;cobalt(3+);trichloride?
2,6-bis(1-ethylimidazol-2-yl)pyridine;cobalt(3+);trichloride has a molecular weight of 432.63 g/mol, XLogP of -6.14, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-bis(1-ethylimidazol-2-yl)pyridine;cobalt(3+);trichloride is sourced from PubChem (CID 70011500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).