diethylazanium;N,N-diethylcarbamodiselenoate

C9H22N2Se2 — CID 134889980

IUPACdiethylazanium;N,N-diethylcarbamodiselenoate
SMILESCCN(CC)C(=[Se])[Se-].CC[NH2+]CC
InChIInChI=1S/C5H11NSe2.C4H11N/c1-3-6(4-2)5(7)8;1-3-5-4-2/h3-4H2,1-2H3,(H,7,8);5H,3-4H2,1-2H3
InChIKeyOYTLSFJIULWGPB-UHFFFAOYSA-N
MW316.21 g/mol
LogP-0.66
Rot. Bonds5

About diethylazanium;N,N-diethylcarbamodiselenoate

diethylazanium;N,N-diethylcarbamodiselenoate (PubChem CID 134889980) has the molecular formula C9H22N2Se2 and a molecular weight of 316.21 g/mol. Its IUPAC name is diethylazanium;N,N-diethylcarbamodiselenoate.

Molecular Properties

Compound Namediethylazanium;N,N-diethylcarbamodiselenoate
PubChem CID134889980
Molecular FormulaC9H22N2Se2
Molecular Weight316.21 g/mol
Exact Mass318.01
IUPAC Namediethylazanium;N,N-diethylcarbamodiselenoate
SMILESCCN(CC)C(=[Se])[Se-].CC[NH2+]CC
InChIInChI=1S/C5H11NSe2.C4H11N/c1-3-6(4-2)5(7)8;1-3-5-4-2/h3-4H2,1-2H3,(H,7,8);5H,3-4H2,1-2H3
InChIKeyOYTLSFJIULWGPB-UHFFFAOYSA-N
XLogP-0.66
TPSA19.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.21
LogP ≤ 5-0.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

zinc bis(N,N-diethylcarbamodiselenoate)
CID 101233041
potassium N,N-diethylcarbamodiselenoate
CID 158172658
diethylazanium;propane
CID 22646025
1-N,1-N,1-N',1-N',2-N,2-N,2-N',2-N'-octaethylethene-1,1,2,2-tetramine
CID 101365533
(diethylcarbamoselenoyldiselanyl) N,N-diethylcarbamodiselenoate
CID 11017193
1,1,3,3-tetraethylurea;hydrofluoride
CID 175553250
1,3-diethyl-1,3-dimethylselenourea
CID 134989232
N,N,2-triethyl-4-methylpentanamide
CID 170847895
cadmium(2+);bis(N-hexyl-N-methylcarbamodiselenoate)
CID 101413419
N,N-diethylcarbamodithioate
CID 28343
N,N-diethylpropanethioamide
CID 638150
CID 21059295
CID 21059295

Frequently Asked Questions

What is the IUPAC name of diethylazanium;N,N-diethylcarbamodiselenoate?
The IUPAC name of diethylazanium;N,N-diethylcarbamodiselenoate (CID 134889980) is diethylazanium;N,N-diethylcarbamodiselenoate.
What is the SMILES notation for diethylazanium;N,N-diethylcarbamodiselenoate?
The canonical SMILES for diethylazanium;N,N-diethylcarbamodiselenoate is CCN(CC)C(=[Se])[Se-].CC[NH2+]CC.
What is the InChIKey of diethylazanium;N,N-diethylcarbamodiselenoate?
The InChIKey is OYTLSFJIULWGPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NSe2.C4H11N/c1-3-6(4-2)5(7)8;1-3-5-4-2/h3-4H2,1-2H3,(H,7,8);5H,3-4H2,1-2H3.
What are the key properties of diethylazanium;N,N-diethylcarbamodiselenoate?
diethylazanium;N,N-diethylcarbamodiselenoate has a molecular weight of 316.21 g/mol, XLogP of -0.66, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for diethylazanium;N,N-diethylcarbamodiselenoate is sourced from PubChem (CID 134889980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).