1-(3-Hydroxy-1-azetidinyl)ethanone

C₅H₉NO₂CAS 118972-96-6115.13 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₅H₉NO₂
Molar mass: 115.13 g/mol
Exact mass: 115.0633 Da
logP: -0.79Crippen estimate
Polar surface area: 40.5 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 0

Identifiers

CAS number

118972-96-6

SMILES

CC(=O)N1CC(O)C1

InChIKey

CSJAIVZAJZXEAW-UHFFFAOYSA-N

InChI

InChI=1S/C5H9NO2/c1-4(7)6-2-5(8)3-6/h5,8H,2-3H2,1H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

4 names

Ethanone, 1-(3-hydroxy-1-azetidinyl)-
3-Azetidinol, 1-acetyl-
1-(3-Hydroxyazetidin-1-yl)ethan-1-one
1-Acetyl-3-hydroxyazetidine

Work with 1-(3-Hydroxy-1-azetidinyl)ethanone

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

N-Acetylpyrrolidine4030-18-646 % similar N,N-Diethylacetamide685-91-646 % similar Oxaceprol33996-33-746 % similar 1-Acetylpiperidine618-42-844 % similar 1-Acetyl-4-piperidinecarboxylic acid25503-90-642 % similar 1-Acetylpiperazine13889-98-041 % similar N-Acetylmorpholine1696-20-441 % similar 1-Acetyl-4-piperidone32161-06-141 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

N-Methyldiacetamide1113-68-4 Methyl 3-amino-2-butenoate14205-39-1 Proline147-85-3 N-(Hydroxymethyl)-2-pyrrolidone15438-71-8 (5S)-5-(Hydroxymethyl)-2-pyrrolidinone17342-08-4 N-Methylacetoacetamide20306-75-6 1-Aminocyclobutanecarboxylic acid22264-50-2 D-Proline344-25-2

Elsewhere

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