1-Cbz-4-methylene-piperidine

C14H17NO2CAS 138163-12-9231.29 g/mol

Open in Covalent MOL file
NOO
AlkeneCarbamate

Properties

Molecular formula
C14H17NO2
Molar mass
231.29 g/mol
Exact mass
231.1259 Da
logP
2.98Crippen estimate
Polar surface area
29.5 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

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

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
138163-12-9
SMILES
C=C1CCN(CC1)C(=O)OCC2=CC=CC=C2
InChIKey
FQLKVNIQHUASLU-UHFFFAOYSA-N
InChI
InChI=1S/C14H17NO2/c1-12-7-9-15(10-8-12)14(16)17-11-13-5-3-2-4-6-13/h2-6H,1,7-11H2

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Names and synonyms

1 names
  • Benzyl 4-methylidenepiperidine-1-carboxylate

Work with 1-Cbz-4-methylene-piperidine

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

Benzyl 4-oxo-1-piperidinecarboxylate19099-93-575 % similar Benzyl 3-oxopyrrolidine-1-carboxylate130312-02-668 % similar Benzyl piperazine-1-carboxylate31166-44-666 % similar Benzyl 1,4-diazepane-1-carboxylate117009-97-961 % similar 4-Amino-piperidine-1-carboxylic acid benzyl ester120278-07-161 % similar Benzyl 3-oxopiperidine-1-carboxylate61995-20-861 % similar N-(Benzyloxycarbonyl)-4-hydroxypiperidine95798-23-561 % similar Benzyl 3-pyrroline-1-carboxylate31970-04-461 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

7-Benzyl-3-oxa-7-azabicyclo[3.3.1]nonan-9-one77716-01-9 4-Methyl-7-diethylaminocoumarin91-44-1

Elsewhere

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