benzeneselenolate;cadmium(2+);N,N,N',N'-tetramethylethane-1,2-diamine

C18H26CdN2Se2 — CID 139129590

IUPACbenzeneselenolate;cadmium(2+);N,N,N',N'-tetramethylethane-1,2-diamine
SMILESCN(C)CCN(C)C.[Cd+2].[Se-]c1ccccc1.[Se-]c1ccccc1
InChIInChI=1S/C6H16N2.2C6H6Se.Cd/c1-7(2)5-6-8(3)4;2*7-6-4-2-1-3-5-6;/h5-6H2,1-4H3;2*1-5,7H;/q;;;+2/p-2
InChIKeyRGNYDARSGCZIOM-UHFFFAOYSA-L
MW540.75 g/mol
LogP1.07
Rot. Bonds3

About benzeneselenolate;cadmium(2+);N,N,N',N'-tetramethylethane-1,2-diamine

benzeneselenolate;cadmium(2+);N,N,N',N'-tetramethylethane-1,2-diamine (PubChem CID 139129590) has the molecular formula C18H26CdN2Se2 and a molecular weight of 540.75 g/mol. Its IUPAC name is benzeneselenolate;cadmium(2+);N,N,N',N'-tetramethylethane-1,2-diamine.

Molecular Properties

Compound Namebenzeneselenolate;cadmium(2+);N,N,N',N'-tetramethylethane-1,2-diamine
PubChem CID139129590
Molecular FormulaC18H26CdN2Se2
Molecular Weight540.75 g/mol
Exact Mass543.95
IUPAC Namebenzeneselenolate;cadmium(2+);N,N,N',N'-tetramethylethane-1,2-diamine
SMILESCN(C)CCN(C)C.[Cd+2].[Se-]c1ccccc1.[Se-]c1ccccc1
InChIInChI=1S/C6H16N2.2C6H6Se.Cd/c1-7(2)5-6-8(3)4;2*7-6-4-2-1-3-5-6;/h5-6H2,1-4H3;2*1-5,7H;/q;;;+2/p-2
InChIKeyRGNYDARSGCZIOM-UHFFFAOYSA-L
XLogP1.07
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500540.75
LogP ≤ 51.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze benzeneselenolate;cadmium(2+);N,N,N',N'-tetramethylethane-1,2-diamine 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 benzeneselenolate;cadmium(2+);N,N,N',N'-tetramethylethane-1,2-diamine?
The IUPAC name of benzeneselenolate;cadmium(2+);N,N,N',N'-tetramethylethane-1,2-diamine (CID 139129590) is benzeneselenolate;cadmium(2+);N,N,N',N'-tetramethylethane-1,2-diamine.
What is the SMILES notation for benzeneselenolate;cadmium(2+);N,N,N',N'-tetramethylethane-1,2-diamine?
The canonical SMILES for benzeneselenolate;cadmium(2+);N,N,N',N'-tetramethylethane-1,2-diamine is CN(C)CCN(C)C.[Cd+2].[Se-]c1ccccc1.[Se-]c1ccccc1.
What is the InChIKey of benzeneselenolate;cadmium(2+);N,N,N',N'-tetramethylethane-1,2-diamine?
The InChIKey is RGNYDARSGCZIOM-UHFFFAOYSA-L. The full InChI is InChI=1S/C6H16N2.2C6H6Se.Cd/c1-7(2)5-6-8(3)4;2*7-6-4-2-1-3-5-6;/h5-6H2,1-4H3;2*1-5,7H;/q;;;+2/p-2.
What are the key properties of benzeneselenolate;cadmium(2+);N,N,N',N'-tetramethylethane-1,2-diamine?
benzeneselenolate;cadmium(2+);N,N,N',N'-tetramethylethane-1,2-diamine has a molecular weight of 540.75 g/mol, XLogP of 1.07, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for benzeneselenolate;cadmium(2+);N,N,N',N'-tetramethylethane-1,2-diamine is sourced from PubChem (CID 139129590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).