cobalt;bis(2-methyl-6-(6-methyl-2-pyridinyl)pyridine)

C24H24CoN4 — CID 140793716

IUPACcobalt;bis(2-methyl-6-(6-methyl-2-pyridinyl)pyridine)
SMILESCc1cccc(-c2cccc(C)n2)n1.Cc1cccc(-c2cccc(C)n2)n1.[Co]
InChIInChI=1S/2C12H12N2.Co/c2*1-9-5-3-7-11(13-9)12-8-4-6-10(2)14-12;/h2*3-8H,1-2H3;
InChIKeyUCFSGNLSRJRXBL-UHFFFAOYSA-N
MW427.42 g/mol
LogP5.52
Rot. Bonds2

About cobalt;bis(2-methyl-6-(6-methyl-2-pyridinyl)pyridine)

cobalt;bis(2-methyl-6-(6-methyl-2-pyridinyl)pyridine) (PubChem CID 140793716) has the molecular formula C24H24CoN4 and a molecular weight of 427.42 g/mol. Its IUPAC name is cobalt;bis(2-methyl-6-(6-methyl-2-pyridinyl)pyridine).

Molecular Properties

Compound Namecobalt;bis(2-methyl-6-(6-methyl-2-pyridinyl)pyridine)
PubChem CID140793716
Molecular FormulaC24H24CoN4
Molecular Weight427.42 g/mol
Exact Mass427.13
IUPAC Namecobalt;bis(2-methyl-6-(6-methyl-2-pyridinyl)pyridine)
SMILESCc1cccc(-c2cccc(C)n2)n1.Cc1cccc(-c2cccc(C)n2)n1.[Co]
InChIInChI=1S/2C12H12N2.Co/c2*1-9-5-3-7-11(13-9)12-8-4-6-10(2)14-12;/h2*3-8H,1-2H3;
InChIKeyUCFSGNLSRJRXBL-UHFFFAOYSA-N
XLogP5.52
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms29
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500427.42
LogP ≤ 55.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of cobalt;bis(2-methyl-6-(6-methyl-2-pyridinyl)pyridine)?
The IUPAC name of cobalt;bis(2-methyl-6-(6-methyl-2-pyridinyl)pyridine) (CID 140793716) is cobalt;bis(2-methyl-6-(6-methyl-2-pyridinyl)pyridine).
What is the SMILES notation for cobalt;bis(2-methyl-6-(6-methyl-2-pyridinyl)pyridine)?
The canonical SMILES for cobalt;bis(2-methyl-6-(6-methyl-2-pyridinyl)pyridine) is Cc1cccc(-c2cccc(C)n2)n1.Cc1cccc(-c2cccc(C)n2)n1.[Co].
What is the InChIKey of cobalt;bis(2-methyl-6-(6-methyl-2-pyridinyl)pyridine)?
The InChIKey is UCFSGNLSRJRXBL-UHFFFAOYSA-N. The full InChI is InChI=1S/2C12H12N2.Co/c2*1-9-5-3-7-11(13-9)12-8-4-6-10(2)14-12;/h2*3-8H,1-2H3;.
What are the key properties of cobalt;bis(2-methyl-6-(6-methyl-2-pyridinyl)pyridine)?
cobalt;bis(2-methyl-6-(6-methyl-2-pyridinyl)pyridine) has a molecular weight of 427.42 g/mol, XLogP of 5.52, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cobalt;bis(2-methyl-6-(6-methyl-2-pyridinyl)pyridine) is sourced from PubChem (CID 140793716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).