tetraethylazanium

C8H20N+ — CID 5413

IUPACtetraethylazanium
SMILESCC[N+](CC)(CC)CC
InChIInChI=1S/C8H20N/c1-5-9(6-2,7-3)8-4/h5-8H2,1-4H3/q+1
InChIKeyCBXCPBUEXACCNR-UHFFFAOYSA-N
MW130.25 g/mol
LogP1.88
Rot. Bonds4

About tetraethylazanium

tetraethylazanium (PubChem CID 5413) has the molecular formula C8H20N+ and a molecular weight of 130.25 g/mol. Its IUPAC name is tetraethylazanium.

Molecular Properties

Compound Nametetraethylazanium
PubChem CID5413
Molecular FormulaC8H20N+
Molecular Weight130.25 g/mol
Exact Mass130.16
IUPAC Nametetraethylazanium
SMILESCC[N+](CC)(CC)CC
InChIInChI=1S/C8H20N/c1-5-9(6-2,7-3)8-4/h5-8H2,1-4H3/q+1
InChIKeyCBXCPBUEXACCNR-UHFFFAOYSA-N
XLogP1.88
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.25
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of tetraethylazanium?
The IUPAC name of tetraethylazanium (CID 5413) is tetraethylazanium.
What is the SMILES notation for tetraethylazanium?
The canonical SMILES for tetraethylazanium is CC[N+](CC)(CC)CC.
What is the InChIKey of tetraethylazanium?
The InChIKey is CBXCPBUEXACCNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20N/c1-5-9(6-2,7-3)8-4/h5-8H2,1-4H3/q+1.
What are the key properties of tetraethylazanium?
tetraethylazanium has a molecular weight of 130.25 g/mol, XLogP of 1.88, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tetraethylazanium is sourced from PubChem (CID 5413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).