2-aminoethyloxidanium

C2H8NO+ — CID 4272803

IUPAC2-aminoethyloxidanium
SMILESNCC[OH2+]
InChIInChI=1S/C2H7NO/c3-1-2-4/h4H,1-3H2/p+1
InChIKeyHZAXFHJVJLSVMW-UHFFFAOYSA-O
MW62.09 g/mol
LogP-1.33
Rot. Bonds1

About 2-aminoethyloxidanium

2-aminoethyloxidanium (PubChem CID 4272803) has the molecular formula C2H8NO+ and a molecular weight of 62.09 g/mol. Its IUPAC name is 2-aminoethyloxidanium.

Molecular Properties

Compound Name2-aminoethyloxidanium
PubChem CID4272803
Molecular FormulaC2H8NO+
Molecular Weight62.09 g/mol
Exact Mass62.06
IUPAC Name2-aminoethyloxidanium
SMILESNCC[OH2+]
InChIInChI=1S/C2H7NO/c3-1-2-4/h4H,1-3H2/p+1
InChIKeyHZAXFHJVJLSVMW-UHFFFAOYSA-O
XLogP-1.33
TPSA48.92 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50062.09
LogP ≤ 5-1.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Ethanolamine
CID 700
1-Amino-2-propanol
CID 4
3-Amino-1-propanol
CID 9086
(2R)-1-aminopropan-2-ol
CID 439938
Ethanolamine Hydrochloride
CID 74819
(S)-(+)-1-Aminopropan-2-ol
CID 7311736
Ethanolaminium(1+)
CID 444693
(2-Hydroxyethyl)ammonium dihydrogen orthoborate
CID 162220
Ethanol, 2-amino-, hydrobromide (1:1)
CID 90080
(2R)-2-hydroxypropylammonium
CID 446260
Monoethanolamine-iodine
CID 44149088
Ethanol-1,1,2,2-d4-amine
CID 13000300

Frequently Asked Questions

What is the IUPAC name of 2-aminoethyloxidanium?
The IUPAC name of 2-aminoethyloxidanium (CID 4272803) is 2-aminoethyloxidanium.
What is the SMILES notation for 2-aminoethyloxidanium?
The canonical SMILES for 2-aminoethyloxidanium is NCC[OH2+].
What is the InChIKey of 2-aminoethyloxidanium?
The InChIKey is HZAXFHJVJLSVMW-UHFFFAOYSA-O. The full InChI is InChI=1S/C2H7NO/c3-1-2-4/h4H,1-3H2/p+1.
What are the key properties of 2-aminoethyloxidanium?
2-aminoethyloxidanium has a molecular weight of 62.09 g/mol, XLogP of -1.33, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminoethyloxidanium is sourced from PubChem (CID 4272803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).