4-Methoxy-3-pyrrolin-2-one

C₅H₇NO₂CAS 69778-83-2113.12 g/mol

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Alkene Amide Ether Lactam

Properties

Molecular formula: C₅H₇NO₂
Molar mass: 113.12 g/mol
Exact mass: 113.0477 Da
logP: -0.35Crippen estimate
Polar surface area: 38.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

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

69778-83-2

SMILES

COC1=CC(=O)NC1

InChIKey

TXKQBYYDTLOLHA-UHFFFAOYSA-N

InChI

InChI=1S/C5H7NO2/c1-8-4-2-5(7)6-3-4/h2H,3H2,1H3,(H,6,7)

Weigh it out

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Names and synonyms

1 names

4-Methoxy-2,5-dihydro-1H-pyrrol-2-one

Work with 4-Methoxy-3-pyrrolin-2-one

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-Methoxy-2(5H)-furanone69556-70-341 % similar Methyl 4-chloro-3-methoxycrotonate85153-60-238 % similar 1-Methoxycyclohexene931-57-734 % similar Dimethyl iminodiacetate hydrochloride39987-25-233 % similar Dimethyloxalylglycine89464-63-133 % similar Methyl fluoroacetate453-18-932 % similar Methyl sarcosinate hydrochloride13515-93-031 % similar Methyl 3-methyl-2-butenoate924-50-531 % 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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