1,1-Dimethylethyl (2R)-2-ethyl-1-piperazinecarboxylate

C11H22N2O2CAS 393781-70-9214.31 g/mol

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NHNOO
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
Stereocentres
Rin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
393781-70-9
SMILES
CC[C@@H]1CNCCN1C(=O)OC(C)(C)C
InChIKey
CTCGRXDGXGUOTE-SECBINFHSA-N
InChI
InChI=1S/C11H22N2O2/c1-5-9-8-12-6-7-13(9)10(14)15-11(2,3)4/h9,12H,5-8H2,1-4H3/t9-/m1/s1

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Names and synonyms

4 names
  • (R)-1-Boc-2-ethylPiperazine
  • (R)-2-Ethylpiperazine-1-carboxylic acid tert-butyl ester
  • 1-Piperazinecarboxylic acid, 2-ethyl-, 1,1-dimethylethyl ester, (2R)-
  • tert-Butyl (R)-2-ethylpiperazine-1-carboxylate

Work with 1,1-Dimethylethyl (2R)-2-ethyl-1-piperazinecarboxylate

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

tert-Butyl 2-(hydroxymethyl)piperazine-1-carboxylate205434-75-973 % similar 1,1-Dimethylethyl (2S)-2-(2-methylpropyl)-1-piperazinecarboxylate674792-06-471 % similar tert-Butyl 2-methylpiperazine-1-carboxylate120737-78-266 % similar 1,1-Dimethylethyl (2S)-2-methyl-1-piperazinecarboxylate169447-70-566 % similar (R)-1-N-Boc-2-methylpiperazine170033-47-366 % similar (S)-1-Boc-2-isopropylpiperazine674792-05-364 % similar 1,1-Dimethylethyl (2S)-2-(phenylmethyl)-1-piperazinecarboxylate169447-86-364 % similar 1,1-Dimethylethyl 2-(phenylmethyl)-1-piperazinecarboxylate481038-63-564 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-N-Boc-4-N-methyl-aminopiperidine108612-54-0 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

Elsewhere

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