1-Boc-4-methylenepiperidine

C₁₁H₁₉NO₂CAS 159635-49-1197.28 g/mol

Open in Covalent MOL file

Alkene Carbamate

Properties

Molecular formula: C₁₁H₁₉NO₂
Molar mass: 197.28 g/mol
Exact mass: 197.1416 Da
logP: 2.57Crippen estimate
Polar surface area: 29.5 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 0

Identifiers

CAS number

159635-49-1

SMILES

CC(C)(C)OC(=O)N1CCC(=C)CC1

InChIKey

PDTZMULNKGUIEJ-UHFFFAOYSA-N

InChI

InChI=1S/C11H19NO2/c1-9-5-7-12(8-6-9)10(13)14-11(2,3)4/h1,5-8H2,2-4H3

Weigh it out

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

Work with 1-Boc-4-methylenepiperidine

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

1,1-Dimethylethyl 3-methylene-1-pyrrolidinecarboxylate114214-71-084 % similar tert-Butyl 4-oxopiperidine-1-carboxylate79099-07-371 % similar 1,1-Dimethylethyl 1-pyrrolidinecarboxylate86953-79-967 % similar 1,1-Dimethylethyl 1-piperidinecarboxylate75844-69-865 % similar N-Boc-N,N-bis(2-chloroethyl)amine118753-70-161 % similar N-Boc-piperazine57260-71-661 % similar 1,1-Dimethylethyl 9-oxo-3-azaspiro[5.5]undecane-3-carboxylate873924-08-457 % similar 4-Chloro-piperidine-1-carboxylic acid tert-butyl ester154874-94-956 % similar

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

Same formula

(4S)-4-Cyclohexyl-L-proline103201-78-1 2-Ethylhexyl cyanoacetate13361-34-7 1-Methylheptyl 2-cyanoacetate52688-08-1

Elsewhere

PubChem CAS Common Chemistry NIST WebBook