tris(2-hydroxyethyl)azanium

C6H16NO3+ — CID 3777650

IUPACtris(2-hydroxyethyl)azanium
SMILESOCC[NH+](CCO)CCO
InChIInChI=1S/C6H15NO3/c8-4-1-7(2-5-9)3-6-10/h8-10H,1-6H2/p+1
InChIKeyGSEJCLTVZPLZKY-UHFFFAOYSA-O
MW150.20 g/mol
LogP-3.15
Rot. Bonds6

About tris(2-hydroxyethyl)azanium

tris(2-hydroxyethyl)azanium (PubChem CID 3777650) has the molecular formula C6H16NO3+ and a molecular weight of 150.20 g/mol. Its IUPAC name is tris(2-hydroxyethyl)azanium.

Molecular Properties

Compound Nametris(2-hydroxyethyl)azanium
PubChem CID3777650
Molecular FormulaC6H16NO3+
Molecular Weight150.20 g/mol
Exact Mass150.11
IUPAC Nametris(2-hydroxyethyl)azanium
SMILESOCC[NH+](CCO)CCO
InChIInChI=1S/C6H15NO3/c8-4-1-7(2-5-9)3-6-10/h8-10H,1-6H2/p+1
InChIKeyGSEJCLTVZPLZKY-UHFFFAOYSA-O
XLogP-3.15
TPSA65.13 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.20
LogP ≤ 5-3.15
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of tris(2-hydroxyethyl)azanium?
The IUPAC name of tris(2-hydroxyethyl)azanium (CID 3777650) is tris(2-hydroxyethyl)azanium.
What is the SMILES notation for tris(2-hydroxyethyl)azanium?
The canonical SMILES for tris(2-hydroxyethyl)azanium is OCC[NH+](CCO)CCO.
What is the InChIKey of tris(2-hydroxyethyl)azanium?
The InChIKey is GSEJCLTVZPLZKY-UHFFFAOYSA-O. The full InChI is InChI=1S/C6H15NO3/c8-4-1-7(2-5-9)3-6-10/h8-10H,1-6H2/p+1.
What are the key properties of tris(2-hydroxyethyl)azanium?
tris(2-hydroxyethyl)azanium has a molecular weight of 150.20 g/mol, XLogP of -3.15, 6 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tris(2-hydroxyethyl)azanium is sourced from PubChem (CID 3777650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).