copper;N,N'-diethylethane-1,2-diamine;diperchlorate

C6H16Cl2CuN2O8 — CID 173220280

IUPACcopper;N,N'-diethylethane-1,2-diamine;diperchlorate
SMILESCCNCCNCC.[Cu+2].[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-]
InChIInChI=1S/C6H16N2.2ClHO4.Cu/c1-3-7-5-6-8-4-2;2*2-1(3,4)5;/h7-8H,3-6H2,1-2H3;2*(H,2,3,4,5);/q;;;+2/p-2
InChIKeyWTOSXDFSFVMNDA-UHFFFAOYSA-L
MW378.65 g/mol
LogP-9.31
Rot. Bonds5

About copper;N,N'-diethylethane-1,2-diamine;diperchlorate

copper;N,N'-diethylethane-1,2-diamine;diperchlorate (PubChem CID 173220280) has the molecular formula C6H16Cl2CuN2O8 and a molecular weight of 378.65 g/mol. Its IUPAC name is copper;N,N'-diethylethane-1,2-diamine;diperchlorate.

Molecular Properties

Compound Namecopper;N,N'-diethylethane-1,2-diamine;diperchlorate
PubChem CID173220280
Molecular FormulaC6H16Cl2CuN2O8
Molecular Weight378.65 g/mol
Exact Mass376.96
IUPAC Namecopper;N,N'-diethylethane-1,2-diamine;diperchlorate
SMILESCCNCCNCC.[Cu+2].[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-]
InChIInChI=1S/C6H16N2.2ClHO4.Cu/c1-3-7-5-6-8-4-2;2*2-1(3,4)5;/h7-8H,3-6H2,1-2H3;2*(H,2,3,4,5);/q;;;+2/p-2
InChIKeyWTOSXDFSFVMNDA-UHFFFAOYSA-L
XLogP-9.31
TPSA208.54 Ų
H-Bond Donors2
H-Bond Acceptors10
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.65
LogP ≤ 5-9.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

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2-(ethylamino)ethanol;hydroxylamine
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N,N'-diethylpentane-1,5-diamine
CID 15013244
N-(1,2-13C2)ethyl(1,2-13C2)ethanamine
CID 71309791
N-[2-(ethylamino)ethyl]formamide
CID 54012560
N'-[2-[2-(butylamino)ethylamino]ethyl]-N-[2-(ethylamino)ethyl]propane-1,3-diamine
CID 25107796
N-ethyl-N'-[9-(ethylamino)nonyl]nonane-1,9-diamine
CID 58260221
2-(ethylamino)ethaneselenol
CID 171039548
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Frequently Asked Questions

What is the IUPAC name of copper;N,N'-diethylethane-1,2-diamine;diperchlorate?
The IUPAC name of copper;N,N'-diethylethane-1,2-diamine;diperchlorate (CID 173220280) is copper;N,N'-diethylethane-1,2-diamine;diperchlorate.
What is the SMILES notation for copper;N,N'-diethylethane-1,2-diamine;diperchlorate?
The canonical SMILES for copper;N,N'-diethylethane-1,2-diamine;diperchlorate is CCNCCNCC.[Cu+2].[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-].
What is the InChIKey of copper;N,N'-diethylethane-1,2-diamine;diperchlorate?
The InChIKey is WTOSXDFSFVMNDA-UHFFFAOYSA-L. The full InChI is InChI=1S/C6H16N2.2ClHO4.Cu/c1-3-7-5-6-8-4-2;2*2-1(3,4)5;/h7-8H,3-6H2,1-2H3;2*(H,2,3,4,5);/q;;;+2/p-2.
What are the key properties of copper;N,N'-diethylethane-1,2-diamine;diperchlorate?
copper;N,N'-diethylethane-1,2-diamine;diperchlorate has a molecular weight of 378.65 g/mol, XLogP of -9.31, 5 rotatable bonds, 2 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for copper;N,N'-diethylethane-1,2-diamine;diperchlorate is sourced from PubChem (CID 173220280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).