copper(1+);quinoline-2-carboxylate

C10H6CuNO2 — CID 159046158

IUPACcopper(1+);quinoline-2-carboxylate
SMILESO=C([O-])c1ccc2ccccc2n1.[Cu+]
InChIInChI=1S/C10H7NO2.Cu/c12-10(13)9-6-5-7-3-1-2-4-8(7)11-9;/h1-6H,(H,12,13);/q;+1/p-1
InChIKeyJWRJJCZFGOETPF-UHFFFAOYSA-M
MW235.71 g/mol
LogP0.60
Rot. Bonds1

About copper(1+);quinoline-2-carboxylate

copper(1+);quinoline-2-carboxylate (PubChem CID 159046158) has the molecular formula C10H6CuNO2 and a molecular weight of 235.71 g/mol. Its IUPAC name is copper(1+);quinoline-2-carboxylate.

Molecular Properties

Compound Namecopper(1+);quinoline-2-carboxylate
PubChem CID159046158
Molecular FormulaC10H6CuNO2
Molecular Weight235.71 g/mol
Exact Mass234.97
IUPAC Namecopper(1+);quinoline-2-carboxylate
SMILESO=C([O-])c1ccc2ccccc2n1.[Cu+]
InChIInChI=1S/C10H7NO2.Cu/c12-10(13)9-6-5-7-3-1-2-4-8(7)11-9;/h1-6H,(H,12,13);/q;+1/p-1
InChIKeyJWRJJCZFGOETPF-UHFFFAOYSA-M
XLogP0.60
TPSA53.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.71
LogP ≤ 50.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

iridium(3+);tris(quinoline-2-carboxylate)
CID 161052613
tris(quinoline-2-carboxylate);ruthenium(3+)
CID 15777317
chromium(3+);tris(quinoline-2-carboxylate)
CID 86616048
tricopper;bis(pyridine-2,3-dicarboxylate);bis(quinoline-2-carboxylate)
CID 70528464
manganese;bis(quinoline-2-carboxylic acid);benzoate
CID 139073952
europium;quinoline-2-carboxylic acid
CID 87730482
copper;quinoline-2-carboxylic acid
CID 68537473
(2-phenylphenoxy)aluminum(2+);bis(quinoline-2-carboxylate)
CID 161019161
quinoline-2-carboxamide;hydrobromide
CID 141009871
potassium;hydride;quinoline-2-carboxylic acid
CID 174828478
1,6-naphthyridine-2-carboxylate
CID 6930972
2-amino-1-quinolin-2-ylethanone
CID 23532024

Frequently Asked Questions

What is the IUPAC name of copper(1+);quinoline-2-carboxylate?
The IUPAC name of copper(1+);quinoline-2-carboxylate (CID 159046158) is copper(1+);quinoline-2-carboxylate.
What is the SMILES notation for copper(1+);quinoline-2-carboxylate?
The canonical SMILES for copper(1+);quinoline-2-carboxylate is O=C([O-])c1ccc2ccccc2n1.[Cu+].
What is the InChIKey of copper(1+);quinoline-2-carboxylate?
The InChIKey is JWRJJCZFGOETPF-UHFFFAOYSA-M. The full InChI is InChI=1S/C10H7NO2.Cu/c12-10(13)9-6-5-7-3-1-2-4-8(7)11-9;/h1-6H,(H,12,13);/q;+1/p-1.
What are the key properties of copper(1+);quinoline-2-carboxylate?
copper(1+);quinoline-2-carboxylate has a molecular weight of 235.71 g/mol, XLogP of 0.60, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for copper(1+);quinoline-2-carboxylate is sourced from PubChem (CID 159046158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).