2,4-Piperidinedione

C₅H₇NO₂CAS 50607-30-2113.12 g/mol

Open in Covalent MOL file

Amide Ketone Lactam

Properties

Molecular formula: C₅H₇NO₂
Molar mass: 113.12 g/mol
Exact mass: 113.0477 Da
logP: -0.53Crippen estimate
Polar surface area: 46.2 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

50607-30-2

SMILES

C1CNC(=O)CC1=O

InChIKey

RDNZDMDLRIQQAX-UHFFFAOYSA-N

InChI

InChI=1S/C5H7NO2/c7-4-1-2-6-5(8)3-4/h1-3H2,(H,6,8)

Weigh it out

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

Names and synonyms

1 names

2,4-Piperadinedione

Work with 2,4-Piperidinedione

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

4-Piperidinone41661-47-643 % similar 1,3-Cyclopentanedione3859-41-443 % similar 1,4-Diazepan-5-one34376-54-042 % similar 3-Pyrrolidinone96-42-440 % similar Cycloheptane-1,3-dione1194-18-939 % similar 1,3-Cyclohexanedione504-02-939 % similar 4-Piperidone hydrochloride41979-39-938 % similar 3-Pyrrolidinone, hydrochloride (1:1)3760-52-936 % similar

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

Same formula

Ethyl cyanoacetate105-56-6 N-Methylsuccinimide1121-07-9 Glutarimide1121-89-7 L-Propargylglycine23235-01-0 Ethyl isocyanoacetate2999-46-4 (5-Methyl-1,2-oxazol-3-yl)methanol35166-33-7 4-Cyanobutanoic acid39201-33-7 3,4-Dehydro-L-proline4043-88-3

Elsewhere

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