1-[(1R)-1-hydroxyethyl]azetidin-2-one

C5H9NO2 — CID 18602378

IUPAC1-[(1R)-1-hydroxyethyl]azetidin-2-one
SMILESC[C@@H](O)N1CCC1=O
InChIInChI=1S/C5H9NO2/c1-4(7)6-3-2-5(6)8/h4,7H,2-3H2,1H3/t4-/m1/s1
InChIKeyKNBKRBGKMMFBBX-SCSAIBSYSA-N
MW115.13 g/mol
LogP-0.44
Rot. Bonds1

About 1-[(1R)-1-hydroxyethyl]azetidin-2-one

1-[(1R)-1-hydroxyethyl]azetidin-2-one (PubChem CID 18602378) has the molecular formula C5H9NO2 and a molecular weight of 115.13 g/mol. Its IUPAC name is 1-[(1R)-1-hydroxyethyl]azetidin-2-one.

Molecular Properties

Compound Name1-[(1R)-1-hydroxyethyl]azetidin-2-one
PubChem CID18602378
Molecular FormulaC5H9NO2
Molecular Weight115.13 g/mol
Exact Mass115.06
IUPAC Name1-[(1R)-1-hydroxyethyl]azetidin-2-one
SMILESC[C@@H](O)N1CCC1=O
InChIInChI=1S/C5H9NO2/c1-4(7)6-3-2-5(6)8/h4,7H,2-3H2,1H3/t4-/m1/s1
InChIKeyKNBKRBGKMMFBBX-SCSAIBSYSA-N
XLogP-0.44
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.13
LogP ≤ 5-0.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-Hydroxyazetidin-1-yl)ethan-1-one
CID 11062345
1-(2-Hydroxyethyl)azetidin-2-one
CID 20378092
1-(Hydroxymethyl)azetidin-2-one
CID 19349766
N-bis(2-hydroxyethyl)propanamide
CID 112269
1-(2-Hydroxyethyl)-3,3-dimethylazetidin-2-one
CID 130127852
N-(2-hydroxyethyl)-N-methylpropionamide
CID 19991879
1-[3-Fluoro-3-(hydroxymethyl)azetidin-1-yl]propan-1-one
CID 127011205
3-(Hydroxymethyl)-1-propylazetidin-2-one
CID 85666498
1-Propanoylazetidin-2-one
CID 10942427
1-(1-Hydroxyethyl)azetidin-2-one
CID 17767228
N-ethyl-N-(hydroxymethyl)propanamide
CID 18715922
1-(3-Hydroxypropyl)azetidin-2-one
CID 20378084

Frequently Asked Questions

What is the IUPAC name of 1-[(1R)-1-hydroxyethyl]azetidin-2-one?
The IUPAC name of 1-[(1R)-1-hydroxyethyl]azetidin-2-one (CID 18602378) is 1-[(1R)-1-hydroxyethyl]azetidin-2-one.
What is the SMILES notation for 1-[(1R)-1-hydroxyethyl]azetidin-2-one?
The canonical SMILES for 1-[(1R)-1-hydroxyethyl]azetidin-2-one is C[C@@H](O)N1CCC1=O.
What is the InChIKey of 1-[(1R)-1-hydroxyethyl]azetidin-2-one?
The InChIKey is KNBKRBGKMMFBBX-SCSAIBSYSA-N. The full InChI is InChI=1S/C5H9NO2/c1-4(7)6-3-2-5(6)8/h4,7H,2-3H2,1H3/t4-/m1/s1.
What are the key properties of 1-[(1R)-1-hydroxyethyl]azetidin-2-one?
1-[(1R)-1-hydroxyethyl]azetidin-2-one has a molecular weight of 115.13 g/mol, XLogP of -0.44, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1R)-1-hydroxyethyl]azetidin-2-one is sourced from PubChem (CID 18602378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).