2-aminooxy-5-(dimethylamino)phenol

C8H12N2O2 — CID 58369946

IUPAC2-aminooxy-5-(dimethylamino)phenol
SMILESCN(C)c1ccc(ON)c(O)c1
InChIInChI=1S/C8H12N2O2/c1-10(2)6-3-4-8(12-9)7(11)5-6/h3-5,11H,9H2,1-2H3
InChIKeyKYHANXCYQFSJHD-UHFFFAOYSA-N
MW168.20 g/mol
LogP0.71
Rot. Bonds2

About 2-aminooxy-5-(dimethylamino)phenol

2-aminooxy-5-(dimethylamino)phenol (PubChem CID 58369946) has the molecular formula C8H12N2O2 and a molecular weight of 168.20 g/mol. Its IUPAC name is 2-aminooxy-5-(dimethylamino)phenol.

Molecular Properties

Compound Name2-aminooxy-5-(dimethylamino)phenol
PubChem CID58369946
Molecular FormulaC8H12N2O2
Molecular Weight168.20 g/mol
Exact Mass168.09
IUPAC Name2-aminooxy-5-(dimethylamino)phenol
SMILESCN(C)c1ccc(ON)c(O)c1
InChIInChI=1S/C8H12N2O2/c1-10(2)6-3-4-8(12-9)7(11)5-6/h3-5,11H,9H2,1-2H3
InChIKeyKYHANXCYQFSJHD-UHFFFAOYSA-N
XLogP0.71
TPSA58.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.20
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-aminooxy-5-(dimethylamino)phenol 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 2-aminooxy-5-(dimethylamino)phenol?
The IUPAC name of 2-aminooxy-5-(dimethylamino)phenol (CID 58369946) is 2-aminooxy-5-(dimethylamino)phenol.
What is the SMILES notation for 2-aminooxy-5-(dimethylamino)phenol?
The canonical SMILES for 2-aminooxy-5-(dimethylamino)phenol is CN(C)c1ccc(ON)c(O)c1.
What is the InChIKey of 2-aminooxy-5-(dimethylamino)phenol?
The InChIKey is KYHANXCYQFSJHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O2/c1-10(2)6-3-4-8(12-9)7(11)5-6/h3-5,11H,9H2,1-2H3.
What are the key properties of 2-aminooxy-5-(dimethylamino)phenol?
2-aminooxy-5-(dimethylamino)phenol has a molecular weight of 168.20 g/mol, XLogP of 0.71, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminooxy-5-(dimethylamino)phenol is sourced from PubChem (CID 58369946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).