2-(2-aminooxy-2-methylpropyl)phenol

C10H15NO2 — CID 117104866

IUPAC2-(2-aminooxy-2-methylpropyl)phenol
SMILESCC(C)(Cc1ccccc1O)ON
InChIInChI=1S/C10H15NO2/c1-10(2,13-11)7-8-5-3-4-6-9(8)12/h3-6,12H,7,11H2,1-2H3
InChIKeyMPYYSJVRFJTYEK-UHFFFAOYSA-N
MW181.24 g/mol
LogP1.60
Rot. Bonds3

About 2-(2-aminooxy-2-methylpropyl)phenol

2-(2-aminooxy-2-methylpropyl)phenol (PubChem CID 117104866) has the molecular formula C10H15NO2 and a molecular weight of 181.24 g/mol. Its IUPAC name is 2-(2-aminooxy-2-methylpropyl)phenol.

Molecular Properties

Compound Name2-(2-aminooxy-2-methylpropyl)phenol
PubChem CID117104866
Molecular FormulaC10H15NO2
Molecular Weight181.24 g/mol
Exact Mass181.11
IUPAC Name2-(2-aminooxy-2-methylpropyl)phenol
SMILESCC(C)(Cc1ccccc1O)ON
InChIInChI=1S/C10H15NO2/c1-10(2,13-11)7-8-5-3-4-6-9(8)12/h3-6,12H,7,11H2,1-2H3
InChIKeyMPYYSJVRFJTYEK-UHFFFAOYSA-N
XLogP1.60
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(2-amino-2-methylpropyl)phenol
CID 22723438
2-(2-butoxy-2-methylpropyl)phenol
CID 67182146
2-(3-hydroxy-2,2-dimethylpropyl)phenol
CID 135339227
2-[2-methyl-2-(1-methylcyclopentyl)oxypropyl]phenol
CID 67181000
2-(2-decoxy-2-methylpropyl)phenol
CID 67181132
2-[2-[2-(aminomethyl)phenyl]-2-methylpropyl]phenol
CID 150452030
benzyl 3-(2-hydroxyphenyl)-2,2-dimethylpropanoate
CID 168825987
2-(3-amino-3-methylbutyl)phenol
CID 19863683
2-(2-cyclopentyl-2-methylpropyl)phenol
CID 160603986
2-(2-methoxy-2-methylpropyl)benzoic acid
CID 117111489
2-[[(1-amino-2-methylpropan-2-yl)amino]methyl]phenol
CID 174179021
2,2-bis[(2-hydroxyphenyl)methyl]propanedioic acid
CID 70599857

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminooxy-2-methylpropyl)phenol?
The IUPAC name of 2-(2-aminooxy-2-methylpropyl)phenol (CID 117104866) is 2-(2-aminooxy-2-methylpropyl)phenol.
What is the SMILES notation for 2-(2-aminooxy-2-methylpropyl)phenol?
The canonical SMILES for 2-(2-aminooxy-2-methylpropyl)phenol is CC(C)(Cc1ccccc1O)ON.
What is the InChIKey of 2-(2-aminooxy-2-methylpropyl)phenol?
The InChIKey is MPYYSJVRFJTYEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2/c1-10(2,13-11)7-8-5-3-4-6-9(8)12/h3-6,12H,7,11H2,1-2H3.
What are the key properties of 2-(2-aminooxy-2-methylpropyl)phenol?
2-(2-aminooxy-2-methylpropyl)phenol has a molecular weight of 181.24 g/mol, XLogP of 1.60, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminooxy-2-methylpropyl)phenol is sourced from PubChem (CID 117104866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).