2-(dimethylaminooxy)ethanamine;hydrochloride

C4H13ClN2O — CID 20569339

IUPAC2-(dimethylaminooxy)ethanamine;hydrochloride
SMILESCN(C)OCCN.Cl
InChIInChI=1S/C4H12N2O.ClH/c1-6(2)7-4-3-5;/h3-5H2,1-2H3;1H
InChIKeyXGGISUZATRTFBH-UHFFFAOYSA-N
MW140.61 g/mol
LogP-0.14
Rot. Bonds3

About 2-(dimethylaminooxy)ethanamine;hydrochloride

2-(dimethylaminooxy)ethanamine;hydrochloride (PubChem CID 20569339) has the molecular formula C4H13ClN2O and a molecular weight of 140.61 g/mol. Its IUPAC name is 2-(dimethylaminooxy)ethanamine;hydrochloride.

Molecular Properties

Compound Name2-(dimethylaminooxy)ethanamine;hydrochloride
PubChem CID20569339
Molecular FormulaC4H13ClN2O
Molecular Weight140.61 g/mol
Exact Mass140.07
IUPAC Name2-(dimethylaminooxy)ethanamine;hydrochloride
SMILESCN(C)OCCN.Cl
InChIInChI=1S/C4H12N2O.ClH/c1-6(2)7-4-3-5;/h3-5H2,1-2H3;1H
InChIKeyXGGISUZATRTFBH-UHFFFAOYSA-N
XLogP-0.14
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.61
LogP ≤ 5-0.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(dimethylaminooxy)ethanamine;hydrochloride?
The IUPAC name of 2-(dimethylaminooxy)ethanamine;hydrochloride (CID 20569339) is 2-(dimethylaminooxy)ethanamine;hydrochloride.
What is the SMILES notation for 2-(dimethylaminooxy)ethanamine;hydrochloride?
The canonical SMILES for 2-(dimethylaminooxy)ethanamine;hydrochloride is CN(C)OCCN.Cl.
What is the InChIKey of 2-(dimethylaminooxy)ethanamine;hydrochloride?
The InChIKey is XGGISUZATRTFBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H12N2O.ClH/c1-6(2)7-4-3-5;/h3-5H2,1-2H3;1H.
What are the key properties of 2-(dimethylaminooxy)ethanamine;hydrochloride?
2-(dimethylaminooxy)ethanamine;hydrochloride has a molecular weight of 140.61 g/mol, XLogP of -0.14, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylaminooxy)ethanamine;hydrochloride is sourced from PubChem (CID 20569339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).