chempirical

1-[(tert-Butoxy)carbonyl]piperidine-2-carboxylic acid

C11H19NO4CAS 118552-55-9229.28 g/mol

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OONOOH
CarbamateCarboxylic acid

Properties

Molecular formula
C11H19NO4
Molar mass
229.28 g/mol
Exact mass
229.1314 Da
logP
1.86Crippen estimate
Polar surface area
66.8 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
1

Identifiers

CAS number
118552-55-9
SMILES
CC(C)(C)OC(=O)N1CCCCC1C(=O)O
InChIKey
JQAOHGMPAAWWQO-UHFFFAOYSA-N
InChI
InChI=1S/C11H19NO4/c1-11(2,3)16-10(15)12-7-5-4-6-8(12)9(13)14/h8H,4-7H2,1-3H3,(H,13,14)

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Names and synonyms

1 names
  • N-Boc-dl-pipecolinic acid

Work with 1-[(tert-Butoxy)carbonyl]piperidine-2-carboxylic acid

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

Boc-L-proline15761-39-492 % similar 4-(tert-Butoxycarbonyl)morpholine-3-carboxylic acid212650-43-665 % similar 1,1-Dimethylethyl (2S)-2-(aminocarbonyl)-1-pyrrolidinecarboxylate35150-07-365 % similar 1-Boc-2-piperazinecarboxylic acid1214196-85-664 % similar 1-(1,1-Dimethylethyl) (2S)-4-oxo-1,2-pyrrolidinedicarboxylate84348-37-860 % similar 1-(1,1-Dimethylethyl) (2S)-4,4-dimethyl-1,2-pyrrolidinedicarboxylate1001353-87-259 % similar tert-Butyl 2-(2-hydroxyethyl)piperidine-1-carboxylate118811-03-359 % similar 1-[(1,1-Dimethylethoxy)carbonyl]-2-piperidinepropanoic acid669713-96-659 % similar

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

Same formula

2-((2R)-1-((tert-Butoxy)carbonyl)pyrrolidin-2-yl)acetic acid101555-60-6 (S)-(-)-3-tert-Butoxycarbonyl-4-formyl-2,2-dimethyl-1,3-oxazolidine102308-32-7 (2S)-1-(tert-Butoxycarbonyl)-2-methylpyrrolidine-2-carboxylic acid103336-06-7 L-Glutamic acid 5-cyclohexyl ester112471-82-6 1-tert-Butyl 3-methyl pyrrolidine-1,3-dicarboxylate122684-33-7 (αS)-α-[[(1,1-Dimethylethoxy)carbonyl]amino]cyclobutaneacetic acid155905-77-4 1-(1,1-Dimethylethyl) (3R)-1,3-piperidinedicarboxylate163438-09-3 (R)-Boc-2-methylproline166170-15-6

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