copper;bis(4-methyl-2-(4-methyl-2-pyridinyl)pyridine)

C24H24CuN4 — CID 23557697

IUPACcopper;bis(4-methyl-2-(4-methyl-2-pyridinyl)pyridine)
SMILESCc1ccnc(-c2cc(C)ccn2)c1.Cc1ccnc(-c2cc(C)ccn2)c1.[Cu]
InChIInChI=1S/2C12H12N2.Cu/c2*1-9-3-5-13-11(7-9)12-8-10(2)4-6-14-12;/h2*3-8H,1-2H3;
InChIKeyXHCHXAZEISGLRN-UHFFFAOYSA-N
MW432.03 g/mol
LogP5.52
Rot. Bonds2

About copper;bis(4-methyl-2-(4-methyl-2-pyridinyl)pyridine)

copper;bis(4-methyl-2-(4-methyl-2-pyridinyl)pyridine) (PubChem CID 23557697) has the molecular formula C24H24CuN4 and a molecular weight of 432.03 g/mol. Its IUPAC name is copper;bis(4-methyl-2-(4-methyl-2-pyridinyl)pyridine).

Molecular Properties

Compound Namecopper;bis(4-methyl-2-(4-methyl-2-pyridinyl)pyridine)
PubChem CID23557697
Molecular FormulaC24H24CuN4
Molecular Weight432.03 g/mol
Exact Mass431.13
IUPAC Namecopper;bis(4-methyl-2-(4-methyl-2-pyridinyl)pyridine)
SMILESCc1ccnc(-c2cc(C)ccn2)c1.Cc1ccnc(-c2cc(C)ccn2)c1.[Cu]
InChIInChI=1S/2C12H12N2.Cu/c2*1-9-3-5-13-11(7-9)12-8-10(2)4-6-14-12;/h2*3-8H,1-2H3;
InChIKeyXHCHXAZEISGLRN-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 ≤ 500432.03
LogP ≤ 55.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of copper;bis(4-methyl-2-(4-methyl-2-pyridinyl)pyridine)?
The IUPAC name of copper;bis(4-methyl-2-(4-methyl-2-pyridinyl)pyridine) (CID 23557697) is copper;bis(4-methyl-2-(4-methyl-2-pyridinyl)pyridine).
What is the SMILES notation for copper;bis(4-methyl-2-(4-methyl-2-pyridinyl)pyridine)?
The canonical SMILES for copper;bis(4-methyl-2-(4-methyl-2-pyridinyl)pyridine) is Cc1ccnc(-c2cc(C)ccn2)c1.Cc1ccnc(-c2cc(C)ccn2)c1.[Cu].
What is the InChIKey of copper;bis(4-methyl-2-(4-methyl-2-pyridinyl)pyridine)?
The InChIKey is XHCHXAZEISGLRN-UHFFFAOYSA-N. The full InChI is InChI=1S/2C12H12N2.Cu/c2*1-9-3-5-13-11(7-9)12-8-10(2)4-6-14-12;/h2*3-8H,1-2H3;.
What are the key properties of copper;bis(4-methyl-2-(4-methyl-2-pyridinyl)pyridine)?
copper;bis(4-methyl-2-(4-methyl-2-pyridinyl)pyridine) has a molecular weight of 432.03 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 copper;bis(4-methyl-2-(4-methyl-2-pyridinyl)pyridine) is sourced from PubChem (CID 23557697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).