[(2S)-azetidin-2-yl]methanol

C4H9NO — CID 10855374

IUPAC[(2S)-azetidin-2-yl]methanol
SMILESOC[C@@H]1CCN1
InChIInChI=1S/C4H9NO/c6-3-4-1-2-5-4/h4-6H,1-3H2/t4-/m0/s1
InChIKeyFTWWNKCHSPDIQW-BYPYZUCNSA-N
MW87.12 g/mol
LogP-0.66
Rot. Bonds1

About [(2S)-azetidin-2-yl]methanol

[(2S)-azetidin-2-yl]methanol (PubChem CID 10855374) has the molecular formula C4H9NO and a molecular weight of 87.12 g/mol. Its IUPAC name is [(2S)-azetidin-2-yl]methanol.

Molecular Properties

Compound Name[(2S)-azetidin-2-yl]methanol
PubChem CID10855374
Molecular FormulaC4H9NO
Molecular Weight87.12 g/mol
Exact Mass87.07
IUPAC Name[(2S)-azetidin-2-yl]methanol
SMILESOC[C@@H]1CCN1
InChIInChI=1S/C4H9NO/c6-3-4-1-2-5-4/h4-6H,1-3H2/t4-/m0/s1
InChIKeyFTWWNKCHSPDIQW-BYPYZUCNSA-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 [(2S)-azetidin-2-yl]methanol?
The IUPAC name of [(2S)-azetidin-2-yl]methanol (CID 10855374) is [(2S)-azetidin-2-yl]methanol.
What is the SMILES notation for [(2S)-azetidin-2-yl]methanol?
The canonical SMILES for [(2S)-azetidin-2-yl]methanol is OC[C@@H]1CCN1.
What is the InChIKey of [(2S)-azetidin-2-yl]methanol?
The InChIKey is FTWWNKCHSPDIQW-BYPYZUCNSA-N. The full InChI is InChI=1S/C4H9NO/c6-3-4-1-2-5-4/h4-6H,1-3H2/t4-/m0/s1.
What are the key properties of [(2S)-azetidin-2-yl]methanol?
[(2S)-azetidin-2-yl]methanol 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 [(2S)-azetidin-2-yl]methanol is sourced from PubChem (CID 10855374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).