copper(1+);thiophene-2-carboxylate

C5H3CuO2S — CID 11194830

IUPACcopper(1+);thiophene-2-carboxylate
SMILESO=C([O-])c1cccs1.[Cu+]
InChIInChI=1S/C5H4O2S.Cu/c6-5(7)4-2-1-3-8-4;/h1-3H,(H,6,7);/q;+1/p-1
InChIKeySFJMFSWCBVEHBA-UHFFFAOYSA-M
MW190.69 g/mol
LogP0.11
Rot. Bonds1

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

copper(1+);thiophene-2-carboxylate (PubChem CID 11194830) has the molecular formula C5H3CuO2S and a molecular weight of 190.69 g/mol. Its IUPAC name is copper(1+);thiophene-2-carboxylate.

Molecular Properties

Compound Namecopper(1+);thiophene-2-carboxylate
PubChem CID11194830
Molecular FormulaC5H3CuO2S
Molecular Weight190.69 g/mol
Exact Mass189.91
IUPAC Namecopper(1+);thiophene-2-carboxylate
SMILESO=C([O-])c1cccs1.[Cu+]
InChIInChI=1S/C5H4O2S.Cu/c6-5(7)4-2-1-3-8-4;/h1-3H,(H,6,7);/q;+1/p-1
InChIKeySFJMFSWCBVEHBA-UHFFFAOYSA-M
XLogP0.11
TPSA40.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.69
LogP ≤ 50.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze copper(1+);thiophene-2-carboxylate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of copper(1+);thiophene-2-carboxylate?
The IUPAC name of copper(1+);thiophene-2-carboxylate (CID 11194830) is copper(1+);thiophene-2-carboxylate.
What is the SMILES notation for copper(1+);thiophene-2-carboxylate?
The canonical SMILES for copper(1+);thiophene-2-carboxylate is O=C([O-])c1cccs1.[Cu+].
What is the InChIKey of copper(1+);thiophene-2-carboxylate?
The InChIKey is SFJMFSWCBVEHBA-UHFFFAOYSA-M. The full InChI is InChI=1S/C5H4O2S.Cu/c6-5(7)4-2-1-3-8-4;/h1-3H,(H,6,7);/q;+1/p-1.
What are the key properties of copper(1+);thiophene-2-carboxylate?
copper(1+);thiophene-2-carboxylate has a molecular weight of 190.69 g/mol, XLogP of 0.11, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for copper(1+);thiophene-2-carboxylate is sourced from PubChem (CID 11194830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).