1-(2-hydroxyethyl)azetidin-3-ol

C5H11NO2 — CID 11182600

IUPAC1-(2-hydroxyethyl)azetidin-3-ol
SMILESOCCN1CC(O)C1
InChIInChI=1S/C5H11NO2/c7-2-1-6-3-5(8)4-6/h5,7-8H,1-4H2
InChIKeyYXITZUROOIVUCI-UHFFFAOYSA-N
MW117.15 g/mol
LogP-1.34
Rot. Bonds2

About 1-(2-hydroxyethyl)azetidin-3-ol

1-(2-hydroxyethyl)azetidin-3-ol (PubChem CID 11182600) has the molecular formula C5H11NO2 and a molecular weight of 117.15 g/mol. Its IUPAC name is 1-(2-hydroxyethyl)azetidin-3-ol.

Molecular Properties

Compound Name1-(2-hydroxyethyl)azetidin-3-ol
PubChem CID11182600
Molecular FormulaC5H11NO2
Molecular Weight117.15 g/mol
Exact Mass117.08
IUPAC Name1-(2-hydroxyethyl)azetidin-3-ol
SMILESOCCN1CC(O)C1
InChIInChI=1S/C5H11NO2/c7-2-1-6-3-5(8)4-6/h5,7-8H,1-4H2
InChIKeyYXITZUROOIVUCI-UHFFFAOYSA-N
XLogP-1.34
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.15
LogP ≤ 5-1.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-hydroxyethyl)azetidin-3-ol?
The IUPAC name of 1-(2-hydroxyethyl)azetidin-3-ol (CID 11182600) is 1-(2-hydroxyethyl)azetidin-3-ol.
What is the SMILES notation for 1-(2-hydroxyethyl)azetidin-3-ol?
The canonical SMILES for 1-(2-hydroxyethyl)azetidin-3-ol is OCCN1CC(O)C1.
What is the InChIKey of 1-(2-hydroxyethyl)azetidin-3-ol?
The InChIKey is YXITZUROOIVUCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO2/c7-2-1-6-3-5(8)4-6/h5,7-8H,1-4H2.
What are the key properties of 1-(2-hydroxyethyl)azetidin-3-ol?
1-(2-hydroxyethyl)azetidin-3-ol has a molecular weight of 117.15 g/mol, XLogP of -1.34, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydroxyethyl)azetidin-3-ol is sourced from PubChem (CID 11182600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).