azetidin-2-ylmethanol

C4H9NO — CID 15251628

IUPACazetidin-2-ylmethanol
SMILESOCC1CCN1
InChIInChI=1S/C4H9NO/c6-3-4-1-2-5-4/h4-6H,1-3H2
InChIKeyFTWWNKCHSPDIQW-UHFFFAOYSA-N
MW87.12 g/mol
LogP-0.66
Rot. Bonds1

About azetidin-2-ylmethanol

azetidin-2-ylmethanol (PubChem CID 15251628) has the molecular formula C4H9NO and a molecular weight of 87.12 g/mol. Its IUPAC name is azetidin-2-ylmethanol.

Molecular Properties

Compound Nameazetidin-2-ylmethanol
PubChem CID15251628
Molecular FormulaC4H9NO
Molecular Weight87.12 g/mol
Exact Mass87.07
IUPAC Nameazetidin-2-ylmethanol
SMILESOCC1CCN1
InChIInChI=1S/C4H9NO/c6-3-4-1-2-5-4/h4-6H,1-3H2
InChIKeyFTWWNKCHSPDIQW-UHFFFAOYSA-N
XLogP-0.66
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50087.12
LogP ≤ 5-0.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of azetidin-2-ylmethanol?
The IUPAC name of azetidin-2-ylmethanol (CID 15251628) is azetidin-2-ylmethanol.
What is the SMILES notation for azetidin-2-ylmethanol?
The canonical SMILES for azetidin-2-ylmethanol is OCC1CCN1.
What is the InChIKey of azetidin-2-ylmethanol?
The InChIKey is FTWWNKCHSPDIQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NO/c6-3-4-1-2-5-4/h4-6H,1-3H2.
What are the key properties of azetidin-2-ylmethanol?
azetidin-2-ylmethanol has a molecular weight of 87.12 g/mol, XLogP of -0.66, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for azetidin-2-ylmethanol is sourced from PubChem (CID 15251628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).