2-aminooxy-1-(4-cyclohexylphenyl)ethanol

C14H21NO2 — CID 82116649

IUPAC2-aminooxy-1-(4-cyclohexylphenyl)ethanol
SMILESNOCC(O)c1ccc(C2CCCCC2)cc1
InChIInChI=1S/C14H21NO2/c15-17-10-14(16)13-8-6-12(7-9-13)11-4-2-1-3-5-11/h6-9,11,14,16H,1-5,10,15H2
InChIKeyWFNKISVVPKEIGK-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.66
Rot. Bonds4

About 2-aminooxy-1-(4-cyclohexylphenyl)ethanol

2-aminooxy-1-(4-cyclohexylphenyl)ethanol (PubChem CID 82116649) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is 2-aminooxy-1-(4-cyclohexylphenyl)ethanol.

Molecular Properties

Compound Name2-aminooxy-1-(4-cyclohexylphenyl)ethanol
PubChem CID82116649
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name2-aminooxy-1-(4-cyclohexylphenyl)ethanol
SMILESNOCC(O)c1ccc(C2CCCCC2)cc1
InChIInChI=1S/C14H21NO2/c15-17-10-14(16)13-8-6-12(7-9-13)11-4-2-1-3-5-11/h6-9,11,14,16H,1-5,10,15H2
InChIKeyWFNKISVVPKEIGK-UHFFFAOYSA-N
XLogP2.66
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.66
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-amino-1-(4-cyclohexylphenyl)ethanol
CID 82114264
2-bromo-1-(4-cyclohexylphenyl)ethanol
CID 116863188
1-(4-cyclobutylphenyl)-2-propan-2-yloxyethanol
CID 105129139
1-(4-cyclohexylphenyl)octan-1-ol
CID 63426970
1-(4-cyclopentylphenyl)hexan-1-ol
CID 91233072
2-aminooxy-1-(4-bromophenyl)ethanol
CID 82115920
1-(4-cyclohexylphenyl)ethane-1,2-diamine
CID 77131240
(1R)-1-(4-cyclohexylphenyl)ethane-1,2-diamine
CID 66517695
1-(4-cyclohexylphenyl)-2-[2-hydroxyethyl(methyl)amino]ethanol
CID 82217099
3-(4-chlorophenyl)sulfanyl-1-(4-cyclohexylphenyl)propan-1-ol
CID 142229088
(4-cyclohexylphenyl)-(4-iodophenyl)methanol
CID 63427013
6-(4-cycloheptylphenyl)-N,6-dihydroxyhexanamide
CID 23503080

Frequently Asked Questions

What is the IUPAC name of 2-aminooxy-1-(4-cyclohexylphenyl)ethanol?
The IUPAC name of 2-aminooxy-1-(4-cyclohexylphenyl)ethanol (CID 82116649) is 2-aminooxy-1-(4-cyclohexylphenyl)ethanol.
What is the SMILES notation for 2-aminooxy-1-(4-cyclohexylphenyl)ethanol?
The canonical SMILES for 2-aminooxy-1-(4-cyclohexylphenyl)ethanol is NOCC(O)c1ccc(C2CCCCC2)cc1.
What is the InChIKey of 2-aminooxy-1-(4-cyclohexylphenyl)ethanol?
The InChIKey is WFNKISVVPKEIGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c15-17-10-14(16)13-8-6-12(7-9-13)11-4-2-1-3-5-11/h6-9,11,14,16H,1-5,10,15H2.
What are the key properties of 2-aminooxy-1-(4-cyclohexylphenyl)ethanol?
2-aminooxy-1-(4-cyclohexylphenyl)ethanol has a molecular weight of 235.33 g/mol, XLogP of 2.66, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminooxy-1-(4-cyclohexylphenyl)ethanol is sourced from PubChem (CID 82116649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).