4-N-Boc-4-N-methyl-aminopiperidine

C11H22N2O2CAS 108612-54-0214.31 g/mol

Open in Covalent MOL file
OONNH
CarbamateSecondary amine

Properties

Molecular formula
C11H22N2O2
Molar mass
214.31 g/mol
Exact mass
214.1681 Da
logP
1.61Crippen estimate
Polar surface area
41.6 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 3 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

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

Identifiers

CAS number
108612-54-0
SMILES
CC(C)(C)OC(=O)N(C)C1CCNCC1
InChIKey
DJJOYDXRUBOZON-UHFFFAOYSA-N
InChI
InChI=1S/C11H22N2O2/c1-11(2,3)15-10(14)13(4)9-5-7-12-8-6-9/h9,12H,5-8H2,1-4H3

Weigh it out

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

Work with 4-N-Boc-4-N-methyl-aminopiperidine

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

3-(N-tert-Butoxycarbonyl-N-methylamino)pyrrolidine172478-00-182 % similar 3-Boc-3-methylaminoazatidine577777-20-974 % similar tert-Butyl N-methyl-N-(piperidin-3-yl)carbamate172478-01-271 % similar tert-Butyl methyl((3R)-piperidin-3-yl)carbamate309962-67-271 % similar tert-Butyl N-methyl-N-(4-oxocyclohexyl)carbamate400899-84-569 % similar tert-Butyl 3,8-diazabicyclo[3.2.1]octane-8-carboxylate149771-44-857 % similar tert-Butyl piperazine-1-carboxylate57260-71-656 % similar 3,6-Diazabicyclo[3.1.1]heptane-6-carboxylic acid tert-butyl ester869494-16-653 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-(Boc-aminomethyl)piperidine135632-53-0 1,1-Dimethylethyl N-[(2S)-2-piperidinylmethyl]carbamate139004-93-6 1,1-Dimethylethyl N-[(2R)-2-piperidinylmethyl]carbamate139004-96-9 tert-Butyl (3R)-3-(aminomethyl)piperidine-1-carboxylate140645-23-4 (S)-3-Aminomethyl-1-piperidinecarboxylic acid tert-butyl ester140645-24-5 tert-Butyl N-((piperidin-2-yl)methyl)carbamate141774-61-0 3-N-Boc-aminomethylpiperidine142643-29-6 1-Boc-4-(aminomethyl)piperidine144222-22-0

Elsewhere

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