copper;2-oxidobenzoate;2-pyridin-2-ylpyridine

C17H12CuN2O3 — CID 24944135

IUPACcopper;2-oxidobenzoate;2-pyridin-2-ylpyridine
SMILESO=C([O-])c1ccccc1[O-].[Cu+2].c1ccc(-c2ccccn2)nc1
InChIInChI=1S/C10H8N2.C7H6O3.Cu/c1-3-7-11-9(5-1)10-6-2-4-8-12-10;8-6-4-2-1-3-5(6)7(9)10;/h1-8H;1-4,8H,(H,9,10);/q;;+2/p-2
InChIKeyJKQIBNBMDJWXCA-UHFFFAOYSA-L
MW355.84 g/mol
LogP1.26
Rot. Bonds2

About copper;2-oxidobenzoate;2-pyridin-2-ylpyridine

copper;2-oxidobenzoate;2-pyridin-2-ylpyridine (PubChem CID 24944135) has the molecular formula C17H12CuN2O3 and a molecular weight of 355.84 g/mol. Its IUPAC name is copper;2-oxidobenzoate;2-pyridin-2-ylpyridine.

Molecular Properties

Compound Namecopper;2-oxidobenzoate;2-pyridin-2-ylpyridine
PubChem CID24944135
Molecular FormulaC17H12CuN2O3
Molecular Weight355.84 g/mol
Exact Mass355.01
IUPAC Namecopper;2-oxidobenzoate;2-pyridin-2-ylpyridine
SMILESO=C([O-])c1ccccc1[O-].[Cu+2].c1ccc(-c2ccccn2)nc1
InChIInChI=1S/C10H8N2.C7H6O3.Cu/c1-3-7-11-9(5-1)10-6-2-4-8-12-10;8-6-4-2-1-3-5(6)7(9)10;/h1-8H;1-4,8H,(H,9,10);/q;;+2/p-2
InChIKeyJKQIBNBMDJWXCA-UHFFFAOYSA-L
XLogP1.26
TPSA88.97 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.84
LogP ≤ 51.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

hexaoxidanium;tetrakis(2-oxidobenzoate);tetrakis(2-pyridin-2-ylpyridine);zinc;tetrahydrate
CID 139059413
dicopper;2-acetyloxybenzoic acid;bis(2-oxidobenzoate);bis(2-pyridin-2-ylpyridine);dihydrate
CID 139056948
tricopper;bis(2-oxidobenzoate);bis(quinolin-8-olate)
CID 69050117
2-pyridin-2-ylpyridine;ruthenium(2+)
CID 140596360
dicopper;tetrakis(2-iodoacetate);bis(2-pyridin-2-ylpyridine);dihydrate
CID 139070149
6-(5-carboxylato-2-pyridinyl)pyridine-3-carboxylate;bis(2-pyridin-2-ylpyridine);ruthenium(2+);dihydrochloride
CID 154729977
copper;methanol;2-oxido-3,5-di(propan-2-yl)benzoate;2-pyridin-2-ylpyridine
CID 139142709
copper;2,6-dipyridin-2-ylpyridine;diacetate;hydrate
CID 139207056
bis(dioxido(oxo)phosphanium);platinum(4+);2-pyridin-2-ylpyridine
CID 175964812
copper;bis(2-hydroxy-3,5-di(propan-2-yl)benzoate);2-pyridin-2-ylpyridine
CID 139206344
dioxidanium;bis((Z)-but-2-enedioate);nickel;tetrakis(2-pyridin-2-ylpyridine);tridecahydrate
CID 139075709
ethanol;oxygen(2-);pyridine-2,6-dicarboxylate;2-pyridin-2-ylpyridine;vanadium(4+)
CID 139080605

Frequently Asked Questions

What is the IUPAC name of copper;2-oxidobenzoate;2-pyridin-2-ylpyridine?
The IUPAC name of copper;2-oxidobenzoate;2-pyridin-2-ylpyridine (CID 24944135) is copper;2-oxidobenzoate;2-pyridin-2-ylpyridine.
What is the SMILES notation for copper;2-oxidobenzoate;2-pyridin-2-ylpyridine?
The canonical SMILES for copper;2-oxidobenzoate;2-pyridin-2-ylpyridine is O=C([O-])c1ccccc1[O-].[Cu+2].c1ccc(-c2ccccn2)nc1.
What is the InChIKey of copper;2-oxidobenzoate;2-pyridin-2-ylpyridine?
The InChIKey is JKQIBNBMDJWXCA-UHFFFAOYSA-L. The full InChI is InChI=1S/C10H8N2.C7H6O3.Cu/c1-3-7-11-9(5-1)10-6-2-4-8-12-10;8-6-4-2-1-3-5(6)7(9)10;/h1-8H;1-4,8H,(H,9,10);/q;;+2/p-2.
What are the key properties of copper;2-oxidobenzoate;2-pyridin-2-ylpyridine?
copper;2-oxidobenzoate;2-pyridin-2-ylpyridine has a molecular weight of 355.84 g/mol, XLogP of 1.26, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for copper;2-oxidobenzoate;2-pyridin-2-ylpyridine is sourced from PubChem (CID 24944135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).