acetaldehyde;tetraethylazanium

C10H24NO+ — CID 57468225

IUPACacetaldehyde;tetraethylazanium
SMILESCC=O.CC[N+](CC)(CC)CC
InChIInChI=1S/C8H20N.C2H4O/c1-5-9(6-2,7-3)8-4;1-2-3/h5-8H2,1-4H3;2H,1H3/q+1;
InChIKeyQIGYMVMDBOCYBE-UHFFFAOYSA-N
MW174.31 g/mol
LogP2.09
Rot. Bonds4

About acetaldehyde;tetraethylazanium

acetaldehyde;tetraethylazanium (PubChem CID 57468225) has the molecular formula C10H24NO+ and a molecular weight of 174.31 g/mol. Its IUPAC name is acetaldehyde;tetraethylazanium.

Molecular Properties

Compound Nameacetaldehyde;tetraethylazanium
PubChem CID57468225
Molecular FormulaC10H24NO+
Molecular Weight174.31 g/mol
Exact Mass174.19
IUPAC Nameacetaldehyde;tetraethylazanium
SMILESCC=O.CC[N+](CC)(CC)CC
InChIInChI=1S/C8H20N.C2H4O/c1-5-9(6-2,7-3)8-4;1-2-3/h5-8H2,1-4H3;2H,1H3/q+1;
InChIKeyQIGYMVMDBOCYBE-UHFFFAOYSA-N
XLogP2.09
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.31
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of acetaldehyde;tetraethylazanium?
The IUPAC name of acetaldehyde;tetraethylazanium (CID 57468225) is acetaldehyde;tetraethylazanium.
What is the SMILES notation for acetaldehyde;tetraethylazanium?
The canonical SMILES for acetaldehyde;tetraethylazanium is CC=O.CC[N+](CC)(CC)CC.
What is the InChIKey of acetaldehyde;tetraethylazanium?
The InChIKey is QIGYMVMDBOCYBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20N.C2H4O/c1-5-9(6-2,7-3)8-4;1-2-3/h5-8H2,1-4H3;2H,1H3/q+1;.
What are the key properties of acetaldehyde;tetraethylazanium?
acetaldehyde;tetraethylazanium has a molecular weight of 174.31 g/mol, XLogP of 2.09, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for acetaldehyde;tetraethylazanium is sourced from PubChem (CID 57468225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).