potassium;boranuide;ethanol

C2H10BKO — CID 174924837

IUPACpotassium;boranuide;ethanol
SMILESCCO.[BH4-].[K+]
InChIInChI=1S/C2H6O.BH4.K/c1-2-3;;/h3H,2H2,1H3;1H4;/q;-1;+1
InChIKeyRGXCUBJYTRLOMS-UHFFFAOYSA-N
MW100.01 g/mol
LogP-4.45
Rot. Bonds

About potassium;boranuide;ethanol

potassium;boranuide;ethanol (PubChem CID 174924837) has the molecular formula C2H10BKO and a molecular weight of 100.01 g/mol. Its IUPAC name is potassium;boranuide;ethanol.

Molecular Properties

Compound Namepotassium;boranuide;ethanol
PubChem CID174924837
Molecular FormulaC2H10BKO
Molecular Weight100.01 g/mol
Exact Mass100.05
IUPAC Namepotassium;boranuide;ethanol
SMILESCCO.[BH4-].[K+]
InChIInChI=1S/C2H6O.BH4.K/c1-2-3;;/h3H,2H2,1H3;1H4;/q;-1;+1
InChIKeyRGXCUBJYTRLOMS-UHFFFAOYSA-N
XLogP-4.45
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms5
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.01
LogP ≤ 5-4.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze potassium;boranuide;ethanol 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;boranuide;ethanol?
The IUPAC name of potassium;boranuide;ethanol (CID 174924837) is potassium;boranuide;ethanol.
What is the SMILES notation for potassium;boranuide;ethanol?
The canonical SMILES for potassium;boranuide;ethanol is CCO.[BH4-].[K+].
What is the InChIKey of potassium;boranuide;ethanol?
The InChIKey is RGXCUBJYTRLOMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H6O.BH4.K/c1-2-3;;/h3H,2H2,1H3;1H4;/q;-1;+1.
What are the key properties of potassium;boranuide;ethanol?
potassium;boranuide;ethanol has a molecular weight of 100.01 g/mol, XLogP of -4.45, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;boranuide;ethanol is sourced from PubChem (CID 174924837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).