dichlorocopper;N,N-diethylethanamine

C6H15Cl2CuN — CID 88694959

IUPACdichlorocopper;N,N-diethylethanamine
SMILESCCN(CC)CC.Cl[Cu]Cl
InChIInChI=1S/C6H15N.2ClH.Cu/c1-4-7(5-2)6-3;;;/h4-6H2,1-3H3;2*1H;/q;;;+2/p-2
InChIKeyLKQGGXRMYFIIQH-UHFFFAOYSA-L
MW235.64 g/mol
LogP2.72
Rot. Bonds3

About dichlorocopper;N,N-diethylethanamine

dichlorocopper;N,N-diethylethanamine (PubChem CID 88694959) has the molecular formula C6H15Cl2CuN and a molecular weight of 235.64 g/mol. Its IUPAC name is dichlorocopper;N,N-diethylethanamine.

Molecular Properties

Compound Namedichlorocopper;N,N-diethylethanamine
PubChem CID88694959
Molecular FormulaC6H15Cl2CuN
Molecular Weight235.64 g/mol
Exact Mass233.99
IUPAC Namedichlorocopper;N,N-diethylethanamine
SMILESCCN(CC)CC.Cl[Cu]Cl
InChIInChI=1S/C6H15N.2ClH.Cu/c1-4-7(5-2)6-3;;;/h4-6H2,1-3H3;2*1H;/q;;;+2/p-2
InChIKeyLKQGGXRMYFIIQH-UHFFFAOYSA-L
XLogP2.72
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.64
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze dichlorocopper;N,N-diethylethanamine 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 dichlorocopper;N,N-diethylethanamine?
The IUPAC name of dichlorocopper;N,N-diethylethanamine (CID 88694959) is dichlorocopper;N,N-diethylethanamine.
What is the SMILES notation for dichlorocopper;N,N-diethylethanamine?
The canonical SMILES for dichlorocopper;N,N-diethylethanamine is CCN(CC)CC.Cl[Cu]Cl.
What is the InChIKey of dichlorocopper;N,N-diethylethanamine?
The InChIKey is LKQGGXRMYFIIQH-UHFFFAOYSA-L. The full InChI is InChI=1S/C6H15N.2ClH.Cu/c1-4-7(5-2)6-3;;;/h4-6H2,1-3H3;2*1H;/q;;;+2/p-2.
What are the key properties of dichlorocopper;N,N-diethylethanamine?
dichlorocopper;N,N-diethylethanamine has a molecular weight of 235.64 g/mol, XLogP of 2.72, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dichlorocopper;N,N-diethylethanamine is sourced from PubChem (CID 88694959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).