potassium cyano(triethyl)boranuide

C7H15BKN — CID 23689584

IUPACpotassium cyano(triethyl)boranuide
SMILESCC[B-](C#N)(CC)CC.[K+]
InChIInChI=1S/C7H15BN.K/c1-4-8(5-2,6-3)7-9;/h4-6H2,1-3H3;/q-1;+1
InChIKeyIFBIEWLZGXHPIW-UHFFFAOYSA-N
MW163.11 g/mol
LogP-0.44
Rot. Bonds3

About potassium cyano(triethyl)boranuide

potassium cyano(triethyl)boranuide (PubChem CID 23689584) has the molecular formula C7H15BKN and a molecular weight of 163.11 g/mol. Its IUPAC name is potassium cyano(triethyl)boranuide.

Molecular Properties

Compound Namepotassium cyano(triethyl)boranuide
PubChem CID23689584
Molecular FormulaC7H15BKN
Molecular Weight163.11 g/mol
Exact Mass163.09
IUPAC Namepotassium cyano(triethyl)boranuide
SMILESCC[B-](C#N)(CC)CC.[K+]
InChIInChI=1S/C7H15BN.K/c1-4-8(5-2,6-3)7-9;/h4-6H2,1-3H3;/q-1;+1
InChIKeyIFBIEWLZGXHPIW-UHFFFAOYSA-N
XLogP-0.44
TPSA23.79 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.11
LogP ≤ 5-0.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of potassium cyano(triethyl)boranuide?
The IUPAC name of potassium cyano(triethyl)boranuide (CID 23689584) is potassium cyano(triethyl)boranuide.
What is the SMILES notation for potassium cyano(triethyl)boranuide?
The canonical SMILES for potassium cyano(triethyl)boranuide is CC[B-](C#N)(CC)CC.[K+].
What is the InChIKey of potassium cyano(triethyl)boranuide?
The InChIKey is IFBIEWLZGXHPIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15BN.K/c1-4-8(5-2,6-3)7-9;/h4-6H2,1-3H3;/q-1;+1.
What are the key properties of potassium cyano(triethyl)boranuide?
potassium cyano(triethyl)boranuide has a molecular weight of 163.11 g/mol, XLogP of -0.44, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for potassium cyano(triethyl)boranuide is sourced from PubChem (CID 23689584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).