copper bis(2-carboxyethylazanide)

C6H12CuN2O4 — CID 157483831

IUPACcopper bis(2-carboxyethylazanide)
SMILES[Cu+2].[NH-]CCC(=O)O.[NH-]CCC(=O)O
InChIInChI=1S/2C3H6NO2.Cu/c2*4-2-1-3(5)6;/h2*4H,1-2H2,(H,5,6);/q2*-1;+2
InChIKeyBWLYKRSKHYTRJA-UHFFFAOYSA-N
MW239.72 g/mol
LogP1.02
Rot. Bonds4

About copper bis(2-carboxyethylazanide)

copper bis(2-carboxyethylazanide) (PubChem CID 157483831) has the molecular formula C6H12CuN2O4 and a molecular weight of 239.72 g/mol. Its IUPAC name is copper bis(2-carboxyethylazanide).

Molecular Properties

Compound Namecopper bis(2-carboxyethylazanide)
PubChem CID157483831
Molecular FormulaC6H12CuN2O4
Molecular Weight239.72 g/mol
Exact Mass239.01
IUPAC Namecopper bis(2-carboxyethylazanide)
SMILES[Cu+2].[NH-]CCC(=O)O.[NH-]CCC(=O)O
InChIInChI=1S/2C3H6NO2.Cu/c2*4-2-1-3(5)6;/h2*4H,1-2H2,(H,5,6);/q2*-1;+2
InChIKeyBWLYKRSKHYTRJA-UHFFFAOYSA-N
XLogP1.02
TPSA122.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.72
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of copper bis(2-carboxyethylazanide)?
The IUPAC name of copper bis(2-carboxyethylazanide) (CID 157483831) is copper bis(2-carboxyethylazanide).
What is the SMILES notation for copper bis(2-carboxyethylazanide)?
The canonical SMILES for copper bis(2-carboxyethylazanide) is [Cu+2].[NH-]CCC(=O)O.[NH-]CCC(=O)O.
What is the InChIKey of copper bis(2-carboxyethylazanide)?
The InChIKey is BWLYKRSKHYTRJA-UHFFFAOYSA-N. The full InChI is InChI=1S/2C3H6NO2.Cu/c2*4-2-1-3(5)6;/h2*4H,1-2H2,(H,5,6);/q2*-1;+2.
What are the key properties of copper bis(2-carboxyethylazanide)?
copper bis(2-carboxyethylazanide) has a molecular weight of 239.72 g/mol, XLogP of 1.02, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for copper bis(2-carboxyethylazanide) is sourced from PubChem (CID 157483831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).