2-aminooxy-1-cyclopropylethanol

C5H11NO2 — CID 22286083

IUPAC2-aminooxy-1-cyclopropylethanol
SMILESNOCC(O)C1CC1
InChIInChI=1S/C5H11NO2/c6-8-3-5(7)4-1-2-4/h4-5,7H,1-3,6H2
InChIKeyVAZCYGKJTUPKGJ-UHFFFAOYSA-N
MW117.15 g/mol
LogP-0.35
Rot. Bonds3

About 2-aminooxy-1-cyclopropylethanol

2-aminooxy-1-cyclopropylethanol (PubChem CID 22286083) has the molecular formula C5H11NO2 and a molecular weight of 117.15 g/mol. Its IUPAC name is 2-aminooxy-1-cyclopropylethanol.

Molecular Properties

Compound Name2-aminooxy-1-cyclopropylethanol
PubChem CID22286083
Molecular FormulaC5H11NO2
Molecular Weight117.15 g/mol
Exact Mass117.08
IUPAC Name2-aminooxy-1-cyclopropylethanol
SMILESNOCC(O)C1CC1
InChIInChI=1S/C5H11NO2/c6-8-3-5(7)4-1-2-4/h4-5,7H,1-3,6H2
InChIKeyVAZCYGKJTUPKGJ-UHFFFAOYSA-N
XLogP-0.35
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.15
LogP ≤ 5-0.35
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

1-cyclopropyl-2-propan-2-yloxyethanol
CID 58386136
(1R)-2-amino-1-cyclopropylethanol
CID 51669576
2-amino-1-cyclopropylethanol
CID 14852098
1-amino-3-cyclopropylpropane-1,3-diol
CID 174886363
1-cyclopropyl-2-(4,4-dimethylcyclohexyl)oxyethanol
CID 114341920
1-(4-ethylcyclohexyl)-2-propan-2-yloxyethanol
CID 79566774
1-(4-methylcyclohexyl)-2-[(2-methylpropan-2-yl)oxy]ethanol
CID 105102501
2-cycloheptyloxy-1-cyclopentylethanol
CID 104753667
1-cyclohexyl-2-(cyclopentylmethoxy)ethanol
CID 104753739
1-(4-ethylcyclohexyl)-2-[(2-methylpropan-2-yl)oxy]ethanol
CID 105103646
2-cyclopropyl-2-hydroxyethanesulfonamide
CID 115013055
1-(4-aminocyclohexyl)propan-1-ol
CID 89389818

Frequently Asked Questions

What is the IUPAC name of 2-aminooxy-1-cyclopropylethanol?
The IUPAC name of 2-aminooxy-1-cyclopropylethanol (CID 22286083) is 2-aminooxy-1-cyclopropylethanol.
What is the SMILES notation for 2-aminooxy-1-cyclopropylethanol?
The canonical SMILES for 2-aminooxy-1-cyclopropylethanol is NOCC(O)C1CC1.
What is the InChIKey of 2-aminooxy-1-cyclopropylethanol?
The InChIKey is VAZCYGKJTUPKGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO2/c6-8-3-5(7)4-1-2-4/h4-5,7H,1-3,6H2.
What are the key properties of 2-aminooxy-1-cyclopropylethanol?
2-aminooxy-1-cyclopropylethanol has a molecular weight of 117.15 g/mol, XLogP of -0.35, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminooxy-1-cyclopropylethanol is sourced from PubChem (CID 22286083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).