1-(hydroxymethyl)azetidin-2-one

C4H7NO2 — CID 19349766

IUPAC1-(hydroxymethyl)azetidin-2-one
SMILESO=C1CCN1CO
InChIInChI=1S/C4H7NO2/c6-3-5-2-1-4(5)7/h6H,1-3H2
InChIKeyQWXYTXBJQQIWHK-UHFFFAOYSA-N
MW101.11 g/mol
LogP-0.83
Rot. Bonds1

About 1-(hydroxymethyl)azetidin-2-one

1-(hydroxymethyl)azetidin-2-one (PubChem CID 19349766) has the molecular formula C4H7NO2 and a molecular weight of 101.11 g/mol. Its IUPAC name is 1-(hydroxymethyl)azetidin-2-one.

Molecular Properties

Compound Name1-(hydroxymethyl)azetidin-2-one
PubChem CID19349766
Molecular FormulaC4H7NO2
Molecular Weight101.11 g/mol
Exact Mass101.05
IUPAC Name1-(hydroxymethyl)azetidin-2-one
SMILESO=C1CCN1CO
InChIInChI=1S/C4H7NO2/c6-3-5-2-1-4(5)7/h6H,1-3H2
InChIKeyQWXYTXBJQQIWHK-UHFFFAOYSA-N
XLogP-0.83
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.11
LogP ≤ 5-0.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(hydroxymethyl)azetidin-2-one?
The IUPAC name of 1-(hydroxymethyl)azetidin-2-one (CID 19349766) is 1-(hydroxymethyl)azetidin-2-one.
What is the SMILES notation for 1-(hydroxymethyl)azetidin-2-one?
The canonical SMILES for 1-(hydroxymethyl)azetidin-2-one is O=C1CCN1CO.
What is the InChIKey of 1-(hydroxymethyl)azetidin-2-one?
The InChIKey is QWXYTXBJQQIWHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7NO2/c6-3-5-2-1-4(5)7/h6H,1-3H2.
What are the key properties of 1-(hydroxymethyl)azetidin-2-one?
1-(hydroxymethyl)azetidin-2-one has a molecular weight of 101.11 g/mol, XLogP of -0.83, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(hydroxymethyl)azetidin-2-one is sourced from PubChem (CID 19349766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).