3-(dimethylaminooxy)-2,3-dimethylbutan-2-ol

C8H19NO2 — CID 174824232

IUPAC3-(dimethylaminooxy)-2,3-dimethylbutan-2-ol
SMILESCN(C)OC(C)(C)C(C)(C)O
InChIInChI=1S/C8H19NO2/c1-7(2,10)8(3,4)11-9(5)6/h10H,1-6H3
InChIKeyIJGURVYSLKSCOH-UHFFFAOYSA-N
MW161.24 g/mol
LogP1.03
Rot. Bonds3

About 3-(dimethylaminooxy)-2,3-dimethylbutan-2-ol

3-(dimethylaminooxy)-2,3-dimethylbutan-2-ol (PubChem CID 174824232) has the molecular formula C8H19NO2 and a molecular weight of 161.24 g/mol. Its IUPAC name is 3-(dimethylaminooxy)-2,3-dimethylbutan-2-ol.

Molecular Properties

Compound Name3-(dimethylaminooxy)-2,3-dimethylbutan-2-ol
PubChem CID174824232
Molecular FormulaC8H19NO2
Molecular Weight161.24 g/mol
Exact Mass161.14
IUPAC Name3-(dimethylaminooxy)-2,3-dimethylbutan-2-ol
SMILESCN(C)OC(C)(C)C(C)(C)O
InChIInChI=1S/C8H19NO2/c1-7(2,10)8(3,4)11-9(5)6/h10H,1-6H3
InChIKeyIJGURVYSLKSCOH-UHFFFAOYSA-N
XLogP1.03
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.24
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 3-(dimethylaminooxy)-2,3-dimethylbutan-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylaminooxy)-2,3-dimethylbutan-2-ol?
The IUPAC name of 3-(dimethylaminooxy)-2,3-dimethylbutan-2-ol (CID 174824232) is 3-(dimethylaminooxy)-2,3-dimethylbutan-2-ol.
What is the SMILES notation for 3-(dimethylaminooxy)-2,3-dimethylbutan-2-ol?
The canonical SMILES for 3-(dimethylaminooxy)-2,3-dimethylbutan-2-ol is CN(C)OC(C)(C)C(C)(C)O.
What is the InChIKey of 3-(dimethylaminooxy)-2,3-dimethylbutan-2-ol?
The InChIKey is IJGURVYSLKSCOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO2/c1-7(2,10)8(3,4)11-9(5)6/h10H,1-6H3.
What are the key properties of 3-(dimethylaminooxy)-2,3-dimethylbutan-2-ol?
3-(dimethylaminooxy)-2,3-dimethylbutan-2-ol has a molecular weight of 161.24 g/mol, XLogP of 1.03, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylaminooxy)-2,3-dimethylbutan-2-ol is sourced from PubChem (CID 174824232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).