3-Methoxy-2-piperidone

C6H11NO2CAS 25219-59-4129.16 g/mol

Open in Covalent MOL file
ONHO
AmideEtherLactam

Properties

Molecular formula
C6H11NO2
Molar mass
129.16 g/mol
Exact mass
129.0790 Da
logP
-0.09Crippen estimate
Polar surface area
38.3 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 39 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P270, P272, P280, P301+P317, P302+P352, P321, P330, P333+P317, P362+P364, P501

Identifiers

CAS number
25219-59-4
SMILES
COC1CCCNC1=O
InChIKey
KCQXYISBJUBSAD-UHFFFAOYSA-N
InChI
InChI=1S/C6H11NO2/c1-9-5-3-2-4-7-6(5)8/h5H,2-4H2,1H3,(H,7,8)

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Names and synonyms

1 names
  • 3-Methoxy-2-piperidinone

Work with 3-Methoxy-2-piperidone

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

(3S)-3-Aminopiperidin-2-one34294-79-647 % similar (S)-2-Methoxycyclohexanone155320-76-645 % similar L-2-Aminohexano-6-lactam21568-87-641 % similar D-Alpha-amino-epsilon-caprolactam28957-33-741 % similar 3-Hydroxy-2-pyrrolidinone15166-68-436 % similar Ethyl 2-oxopyrrolidine-3-carboxylate36821-26-836 % similar 3-Methoxypiperidine4045-29-835 % similar D-Proline methyl ester43041-12-935 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

L-Cyclopropylalanine102735-53-5 D-Cyclopropylalanine121786-39-8 4,4-Dimethoxybutanenitrile14618-78-1 N-Acetylmorpholine1696-20-4 (4S)-(-)-4-Isopropyl-2-oxazolidinone17016-83-0 (+)-Pipecolic acid1723-00-8 Dimethylacetoacetamide2044-64-6 (-)-Nipecotic acid25137-00-2

Elsewhere

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