dibutyl(2-hydroxyethyl)azanium

C10H24NO+ — CID 18920823

IUPACdibutyl(2-hydroxyethyl)azanium
SMILESCCCC[NH+](CCO)CCCC
InChIInChI=1S/C10H23NO/c1-3-5-7-11(9-10-12)8-6-4-2/h12H,3-10H2,1-2H3/p+1
InChIKeyIWSZDQRGNFLMJS-UHFFFAOYSA-O
MW174.31 g/mol
LogP0.46
Rot. Bonds8

About dibutyl(2-hydroxyethyl)azanium

dibutyl(2-hydroxyethyl)azanium (PubChem CID 18920823) has the molecular formula C10H24NO+ and a molecular weight of 174.31 g/mol. Its IUPAC name is dibutyl(2-hydroxyethyl)azanium.

Molecular Properties

Compound Namedibutyl(2-hydroxyethyl)azanium
PubChem CID18920823
Molecular FormulaC10H24NO+
Molecular Weight174.31 g/mol
Exact Mass174.19
IUPAC Namedibutyl(2-hydroxyethyl)azanium
SMILESCCCC[NH+](CCO)CCCC
InChIInChI=1S/C10H23NO/c1-3-5-7-11(9-10-12)8-6-4-2/h12H,3-10H2,1-2H3/p+1
InChIKeyIWSZDQRGNFLMJS-UHFFFAOYSA-O
XLogP0.46
TPSA24.67 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.31
LogP ≤ 50.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

dibutyl(3-hydroxypropyl)azanium
CID 36690466
bis(dihexadecyl(2-hydroxyethyl)azanium);sulfate
CID 139830431
dibutyl(propyl)azanium;propane
CID 176561403
dibutyl(octadecyl)azanium
CID 18405855
tripentylazanium
CID 6993016
CID 22991878
CID 22991878
tris(2-hydroxyethyl)azanium iodide
CID 87105413
butyl-hexyl-pentylazanium chloride
CID 139955344
dodecane-1-sulfonic acid;tris(2-hydroxyethyl)azanium
CID 21435787
tris(2-hydroxyethyl)azanium;undecanoate
CID 142313792
tridodecylazanium iodide
CID 23216258
trihexylazanium bromide
CID 54105866

Frequently Asked Questions

What is the IUPAC name of dibutyl(2-hydroxyethyl)azanium?
The IUPAC name of dibutyl(2-hydroxyethyl)azanium (CID 18920823) is dibutyl(2-hydroxyethyl)azanium.
What is the SMILES notation for dibutyl(2-hydroxyethyl)azanium?
The canonical SMILES for dibutyl(2-hydroxyethyl)azanium is CCCC[NH+](CCO)CCCC.
What is the InChIKey of dibutyl(2-hydroxyethyl)azanium?
The InChIKey is IWSZDQRGNFLMJS-UHFFFAOYSA-O. The full InChI is InChI=1S/C10H23NO/c1-3-5-7-11(9-10-12)8-6-4-2/h12H,3-10H2,1-2H3/p+1.
What are the key properties of dibutyl(2-hydroxyethyl)azanium?
dibutyl(2-hydroxyethyl)azanium has a molecular weight of 174.31 g/mol, XLogP of 0.46, 8 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dibutyl(2-hydroxyethyl)azanium is sourced from PubChem (CID 18920823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).