2-(azetidin-3-yl)-2-fluoroethanol

C5H10FNO — CID 105427164

IUPAC2-(azetidin-3-yl)-2-fluoroethanol
SMILESOCC(F)C1CNC1
InChIInChI=1S/C5H10FNO/c6-5(3-8)4-1-7-2-4/h4-5,7-8H,1-3H2
InChIKeyYWWZGMBLEFSXOE-UHFFFAOYSA-N
MW119.14 g/mol
LogP-0.46
Rot. Bonds2

About 2-(azetidin-3-yl)-2-fluoroethanol

2-(azetidin-3-yl)-2-fluoroethanol (PubChem CID 105427164) has the molecular formula C5H10FNO and a molecular weight of 119.14 g/mol. Its IUPAC name is 2-(azetidin-3-yl)-2-fluoroethanol.

Molecular Properties

Compound Name2-(azetidin-3-yl)-2-fluoroethanol
PubChem CID105427164
Molecular FormulaC5H10FNO
Molecular Weight119.14 g/mol
Exact Mass119.07
IUPAC Name2-(azetidin-3-yl)-2-fluoroethanol
SMILESOCC(F)C1CNC1
InChIInChI=1S/C5H10FNO/c6-5(3-8)4-1-7-2-4/h4-5,7-8H,1-3H2
InChIKeyYWWZGMBLEFSXOE-UHFFFAOYSA-N
XLogP-0.46
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500119.14
LogP ≤ 5-0.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-3-yl)-2-fluoroethanol?
The IUPAC name of 2-(azetidin-3-yl)-2-fluoroethanol (CID 105427164) is 2-(azetidin-3-yl)-2-fluoroethanol.
What is the SMILES notation for 2-(azetidin-3-yl)-2-fluoroethanol?
The canonical SMILES for 2-(azetidin-3-yl)-2-fluoroethanol is OCC(F)C1CNC1.
What is the InChIKey of 2-(azetidin-3-yl)-2-fluoroethanol?
The InChIKey is YWWZGMBLEFSXOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10FNO/c6-5(3-8)4-1-7-2-4/h4-5,7-8H,1-3H2.
What are the key properties of 2-(azetidin-3-yl)-2-fluoroethanol?
2-(azetidin-3-yl)-2-fluoroethanol has a molecular weight of 119.14 g/mol, XLogP of -0.46, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-3-yl)-2-fluoroethanol is sourced from PubChem (CID 105427164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).