copper;2,3-dipyridin-2-ylpyridine;2-pyridin-2-ylpyridine

C25H19CuN5 — CID 175437011

IUPACcopper;2,3-dipyridin-2-ylpyridine;2-pyridin-2-ylpyridine
SMILES[Cu].c1ccc(-c2ccccn2)nc1.c1ccc(-c2cccnc2-c2ccccn2)nc1
InChIInChI=1S/C15H11N3.C10H8N2.Cu/c1-3-9-16-13(7-1)12-6-5-11-18-15(12)14-8-2-4-10-17-14;1-3-7-11-9(5-1)10-6-2-4-8-12-10;/h1-11H;1-8H;
InChIKeyWRGNJLCZLJMEAC-UHFFFAOYSA-N
MW453.01 g/mol
LogP5.35
Rot. Bonds3

About copper;2,3-dipyridin-2-ylpyridine;2-pyridin-2-ylpyridine

copper;2,3-dipyridin-2-ylpyridine;2-pyridin-2-ylpyridine (PubChem CID 175437011) has the molecular formula C25H19CuN5 and a molecular weight of 453.01 g/mol. Its IUPAC name is copper;2,3-dipyridin-2-ylpyridine;2-pyridin-2-ylpyridine.

Molecular Properties

Compound Namecopper;2,3-dipyridin-2-ylpyridine;2-pyridin-2-ylpyridine
PubChem CID175437011
Molecular FormulaC25H19CuN5
Molecular Weight453.01 g/mol
Exact Mass452.09
IUPAC Namecopper;2,3-dipyridin-2-ylpyridine;2-pyridin-2-ylpyridine
SMILES[Cu].c1ccc(-c2ccccn2)nc1.c1ccc(-c2cccnc2-c2ccccn2)nc1
InChIInChI=1S/C15H11N3.C10H8N2.Cu/c1-3-9-16-13(7-1)12-6-5-11-18-15(12)14-8-2-4-10-17-14;1-3-7-11-9(5-1)10-6-2-4-8-12-10;/h1-11H;1-8H;
InChIKeyWRGNJLCZLJMEAC-UHFFFAOYSA-N
XLogP5.35
TPSA64.45 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms31
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500453.01
LogP ≤ 55.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of copper;2,3-dipyridin-2-ylpyridine;2-pyridin-2-ylpyridine?
The IUPAC name of copper;2,3-dipyridin-2-ylpyridine;2-pyridin-2-ylpyridine (CID 175437011) is copper;2,3-dipyridin-2-ylpyridine;2-pyridin-2-ylpyridine.
What is the SMILES notation for copper;2,3-dipyridin-2-ylpyridine;2-pyridin-2-ylpyridine?
The canonical SMILES for copper;2,3-dipyridin-2-ylpyridine;2-pyridin-2-ylpyridine is [Cu].c1ccc(-c2ccccn2)nc1.c1ccc(-c2cccnc2-c2ccccn2)nc1.
What is the InChIKey of copper;2,3-dipyridin-2-ylpyridine;2-pyridin-2-ylpyridine?
The InChIKey is WRGNJLCZLJMEAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N3.C10H8N2.Cu/c1-3-9-16-13(7-1)12-6-5-11-18-15(12)14-8-2-4-10-17-14;1-3-7-11-9(5-1)10-6-2-4-8-12-10;/h1-11H;1-8H;.
What are the key properties of copper;2,3-dipyridin-2-ylpyridine;2-pyridin-2-ylpyridine?
copper;2,3-dipyridin-2-ylpyridine;2-pyridin-2-ylpyridine has a molecular weight of 453.01 g/mol, XLogP of 5.35, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for copper;2,3-dipyridin-2-ylpyridine;2-pyridin-2-ylpyridine is sourced from PubChem (CID 175437011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).