3-[1-(azetidin-3-yl)ethoxy]phenol

C11H15NO2 — CID 105447139

IUPAC3-[1-(azetidin-3-yl)ethoxy]phenol
SMILESCC(Oc1cccc(O)c1)C1CNC1
InChIInChI=1S/C11H15NO2/c1-8(9-6-12-7-9)14-11-4-2-3-10(13)5-11/h2-5,8-9,12-13H,6-7H2,1H3
InChIKeyLOQJYOVBTXYBCF-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.38
Rot. Bonds3

About 3-[1-(azetidin-3-yl)ethoxy]phenol

3-[1-(azetidin-3-yl)ethoxy]phenol (PubChem CID 105447139) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is 3-[1-(azetidin-3-yl)ethoxy]phenol.

Molecular Properties

Compound Name3-[1-(azetidin-3-yl)ethoxy]phenol
PubChem CID105447139
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Name3-[1-(azetidin-3-yl)ethoxy]phenol
SMILESCC(Oc1cccc(O)c1)C1CNC1
InChIInChI=1S/C11H15NO2/c1-8(9-6-12-7-9)14-11-4-2-3-10(13)5-11/h2-5,8-9,12-13H,6-7H2,1H3
InChIKeyLOQJYOVBTXYBCF-UHFFFAOYSA-N
XLogP1.38
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(1-phenoxyethyl)azetidine
CID 105437140
benzene-1,3-diol;3-propan-2-yloxyphenol
CID 159090607
methyl 3-[3-[1-(azetidin-3-yl)ethoxy]phenyl]-3-cyclopropyl-2-methylpropanoate
CID 123456154
3-[1-(3-methoxyphenoxy)ethyl]pyrrolidine
CID 105477836
cyclopropane;methyl 3-[3-[1-(azetidin-3-yl)ethoxy]phenyl]-2-methylpropanoate
CID 144899407
3-[1-(1-methylpiperidin-2-yl)ethoxy]phenol
CID 117095443
3-(3-hydroxybutan-2-yloxy)phenol
CID 77394204
3-but-3-en-2-yloxyphenol
CID 62384342
azetidin-3-yl-(3-propan-2-yloxyphenyl)methanone
CID 116583790
3-(1,1,1-trifluoropropan-2-yloxy)phenol
CID 117095393
3-(1-naphthalen-2-yloxyethyl)pyrrolidine
CID 59544011
3-pyrrolidin-3-yloxyphenol
CID 83482218

Frequently Asked Questions

What is the IUPAC name of 3-[1-(azetidin-3-yl)ethoxy]phenol?
The IUPAC name of 3-[1-(azetidin-3-yl)ethoxy]phenol (CID 105447139) is 3-[1-(azetidin-3-yl)ethoxy]phenol.
What is the SMILES notation for 3-[1-(azetidin-3-yl)ethoxy]phenol?
The canonical SMILES for 3-[1-(azetidin-3-yl)ethoxy]phenol is CC(Oc1cccc(O)c1)C1CNC1.
What is the InChIKey of 3-[1-(azetidin-3-yl)ethoxy]phenol?
The InChIKey is LOQJYOVBTXYBCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2/c1-8(9-6-12-7-9)14-11-4-2-3-10(13)5-11/h2-5,8-9,12-13H,6-7H2,1H3.
What are the key properties of 3-[1-(azetidin-3-yl)ethoxy]phenol?
3-[1-(azetidin-3-yl)ethoxy]phenol has a molecular weight of 193.25 g/mol, XLogP of 1.38, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(azetidin-3-yl)ethoxy]phenol is sourced from PubChem (CID 105447139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).