2-(4-Amino-1-(tert-butoxycarbonyl)piperidin-4-YL)acetic acid

C12H22N2O4CAS 1159983-30-8258.32 g/mol

Open in Covalent MOL file
OONOHONH2
CarbamateCarboxylic acidPrimary amine

Properties

Molecular formula
C12H22N2O4
Molar mass
258.32 g/mol
Exact mass
258.1580 Da
logP
1.19Crippen estimate
Polar surface area
92.9 Ų
H-bond donors / acceptors
2 / 4
Rotatable bonds
2

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
1159983-30-8
SMILES
CC(C)(C)OC(=O)N1CCC(CC1)(CC(=O)O)N
InChIKey
BGBMNGXKKOJOSX-UHFFFAOYSA-N
InChI
InChI=1S/C12H22N2O4/c1-11(2,3)18-10(17)14-6-4-12(13,5-7-14)8-9(15)16/h4-8,13H2,1-3H3,(H,15,16)

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Names and synonyms

1 names
  • 1-Boc-4-amino-4-piperidineacetic acid

Work with 2-(4-Amino-1-(tert-butoxycarbonyl)piperidin-4-YL)acetic 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

4-Amino-1-boc-piperidine-4-carboxylic acid183673-71-459 % similar 4-Boc-1-piperazineacetic acid156478-71-658 % similar N-(tert-Butoxycarbonyl)iminodiacetic Acid56074-20-557 % similar [1-(tert-Butoxycarbonyl)piperidin-4-yl]acetic acid157688-46-556 % similar 1-Boc-4-methyl-piperidin-4-OL406235-30-155 % similar 1-Boc-4-methylpiperidine-4-carboxylic acid189321-63-955 % similar 3-(1-((tert-Butoxy)carbonyl)piperidin-4-yl)propanoic acid154775-43-654 % similar tert-Butyl 2-oxo-7-azaspiro[3.5]nonane-7-carboxylate203661-69-253 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Methyl 4-[(1,1-dimethylethoxy)carbonyl]-2-piperazineacetate183742-33-8 3-(4-(tert-Butoxycarbonyl)piperazin-1-yl)propanoic acid242459-97-8

Elsewhere

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