2-[4-(2-aminooxyethyl)phenoxy]ethanol

C10H15NO3 — CID 117286926

IUPAC2-[4-(2-aminooxyethyl)phenoxy]ethanol
SMILESNOCCc1ccc(OCCO)cc1
InChIInChI=1S/C10H15NO3/c11-14-7-5-9-1-3-10(4-2-9)13-8-6-12/h1-4,12H,5-8,11H2
InChIKeyCCOMAINJLORANF-UHFFFAOYSA-N
MW197.23 g/mol
LogP0.49
Rot. Bonds6

About 2-[4-(2-aminooxyethyl)phenoxy]ethanol

2-[4-(2-aminooxyethyl)phenoxy]ethanol (PubChem CID 117286926) has the molecular formula C10H15NO3 and a molecular weight of 197.23 g/mol. Its IUPAC name is 2-[4-(2-aminooxyethyl)phenoxy]ethanol.

Molecular Properties

Compound Name2-[4-(2-aminooxyethyl)phenoxy]ethanol
PubChem CID117286926
Molecular FormulaC10H15NO3
Molecular Weight197.23 g/mol
Exact Mass197.11
IUPAC Name2-[4-(2-aminooxyethyl)phenoxy]ethanol
SMILESNOCCc1ccc(OCCO)cc1
InChIInChI=1S/C10H15NO3/c11-14-7-5-9-1-3-10(4-2-9)13-8-6-12/h1-4,12H,5-8,11H2
InChIKeyCCOMAINJLORANF-UHFFFAOYSA-N
XLogP0.49
TPSA64.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.23
LogP ≤ 50.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-[4-(2-hydroxyethoxy)phenyl]butan-2-ol
CID 43504158
CID 162335780
CID 162335780
bis[[4-(2-hydroxyethoxy)phenyl]methyl]azanium
CID 102448547
2-[2-[2-[4-[3-[4-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]phenyl]propyl]phenoxy]ethoxy]ethoxy]ethanol
CID 57157923
[4-[2-[4-(2-aminoethyl)phenoxy]ethoxy]phenyl]methanol
CID 61229719
O-[2-(4-bromophenyl)ethyl]hydroxylamine
CID 83486185
CID 90413070
CID 90413070
2-[4-[2-(dimethylamino)ethoxy]phenyl]ethanol
CID 83390498
2-[2-[2-[2-[2-[4-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 102253711
6-[[4-(2-hydroxyethoxy)phenyl]methoxy]hexan-1-ol
CID 126733127
5-(4-butylphenoxy)pentan-1-ol
CID 113322723
2-[4-[7-[4-(2-aminoethyl)phenoxy]heptoxy]phenyl]ethanamine
CID 138454042

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-aminooxyethyl)phenoxy]ethanol?
The IUPAC name of 2-[4-(2-aminooxyethyl)phenoxy]ethanol (CID 117286926) is 2-[4-(2-aminooxyethyl)phenoxy]ethanol.
What is the SMILES notation for 2-[4-(2-aminooxyethyl)phenoxy]ethanol?
The canonical SMILES for 2-[4-(2-aminooxyethyl)phenoxy]ethanol is NOCCc1ccc(OCCO)cc1.
What is the InChIKey of 2-[4-(2-aminooxyethyl)phenoxy]ethanol?
The InChIKey is CCOMAINJLORANF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO3/c11-14-7-5-9-1-3-10(4-2-9)13-8-6-12/h1-4,12H,5-8,11H2.
What are the key properties of 2-[4-(2-aminooxyethyl)phenoxy]ethanol?
2-[4-(2-aminooxyethyl)phenoxy]ethanol has a molecular weight of 197.23 g/mol, XLogP of 0.49, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-aminooxyethyl)phenoxy]ethanol is sourced from PubChem (CID 117286926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).