2-(3-fluoroazetidin-1-yl)ethanol

C5H10FNO — CID 125499608

IUPAC2-(3-fluoroazetidin-1-yl)ethanol
SMILESOCCN1CC(F)C1
InChIInChI=1S/C5H10FNO/c6-5-3-7(4-5)1-2-8/h5,8H,1-4H2
InChIKeyDKEYHHTYEWQUNA-UHFFFAOYSA-N
MW119.14 g/mol
LogP-0.37
Rot. Bonds2

About 2-(3-fluoroazetidin-1-yl)ethanol

2-(3-fluoroazetidin-1-yl)ethanol (PubChem CID 125499608) has the molecular formula C5H10FNO and a molecular weight of 119.14 g/mol. Its IUPAC name is 2-(3-fluoroazetidin-1-yl)ethanol.

Molecular Properties

Compound Name2-(3-fluoroazetidin-1-yl)ethanol
PubChem CID125499608
Molecular FormulaC5H10FNO
Molecular Weight119.14 g/mol
Exact Mass119.07
IUPAC Name2-(3-fluoroazetidin-1-yl)ethanol
SMILESOCCN1CC(F)C1
InChIInChI=1S/C5H10FNO/c6-5-3-7(4-5)1-2-8/h5,8H,1-4H2
InChIKeyDKEYHHTYEWQUNA-UHFFFAOYSA-N
XLogP-0.37
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500119.14
LogP ≤ 5-0.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(3-fluoroazetidin-1-yl)ethanol?
The IUPAC name of 2-(3-fluoroazetidin-1-yl)ethanol (CID 125499608) is 2-(3-fluoroazetidin-1-yl)ethanol.
What is the SMILES notation for 2-(3-fluoroazetidin-1-yl)ethanol?
The canonical SMILES for 2-(3-fluoroazetidin-1-yl)ethanol is OCCN1CC(F)C1.
What is the InChIKey of 2-(3-fluoroazetidin-1-yl)ethanol?
The InChIKey is DKEYHHTYEWQUNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10FNO/c6-5-3-7(4-5)1-2-8/h5,8H,1-4H2.
What are the key properties of 2-(3-fluoroazetidin-1-yl)ethanol?
2-(3-fluoroazetidin-1-yl)ethanol has a molecular weight of 119.14 g/mol, XLogP of -0.37, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluoroazetidin-1-yl)ethanol is sourced from PubChem (CID 125499608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).