potassium N,N-diethylcarbamodiselenoate

C5H10KNSe2 — CID 158172658

IUPACpotassium N,N-diethylcarbamodiselenoate
SMILESCCN(CC)C(=[Se])[Se-].[K+]
InChIInChI=1S/C5H11NSe2.K/c1-3-6(4-2)5(7)8;/h3-4H2,1-2H3,(H,7,8);/q;+1/p-1
InChIKeyFXQIXIREQHGBRY-UHFFFAOYSA-M
MW281.16 g/mol
LogP-3.24
Rot. Bonds3

About potassium N,N-diethylcarbamodiselenoate

potassium N,N-diethylcarbamodiselenoate (PubChem CID 158172658) has the molecular formula C5H10KNSe2 and a molecular weight of 281.16 g/mol. Its IUPAC name is potassium N,N-diethylcarbamodiselenoate.

Molecular Properties

Compound Namepotassium N,N-diethylcarbamodiselenoate
PubChem CID158172658
Molecular FormulaC5H10KNSe2
Molecular Weight281.16 g/mol
Exact Mass282.88
IUPAC Namepotassium N,N-diethylcarbamodiselenoate
SMILESCCN(CC)C(=[Se])[Se-].[K+]
InChIInChI=1S/C5H11NSe2.K/c1-3-6(4-2)5(7)8;/h3-4H2,1-2H3,(H,7,8);/q;+1/p-1
InChIKeyFXQIXIREQHGBRY-UHFFFAOYSA-M
XLogP-3.24
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.16
LogP ≤ 5-3.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze potassium N,N-diethylcarbamodiselenoate 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 potassium N,N-diethylcarbamodiselenoate?
The IUPAC name of potassium N,N-diethylcarbamodiselenoate (CID 158172658) is potassium N,N-diethylcarbamodiselenoate.
What is the SMILES notation for potassium N,N-diethylcarbamodiselenoate?
The canonical SMILES for potassium N,N-diethylcarbamodiselenoate is CCN(CC)C(=[Se])[Se-].[K+].
What is the InChIKey of potassium N,N-diethylcarbamodiselenoate?
The InChIKey is FXQIXIREQHGBRY-UHFFFAOYSA-M. The full InChI is InChI=1S/C5H11NSe2.K/c1-3-6(4-2)5(7)8;/h3-4H2,1-2H3,(H,7,8);/q;+1/p-1.
What are the key properties of potassium N,N-diethylcarbamodiselenoate?
potassium N,N-diethylcarbamodiselenoate has a molecular weight of 281.16 g/mol, XLogP of -3.24, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for potassium N,N-diethylcarbamodiselenoate is sourced from PubChem (CID 158172658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).