chempirical

tert-Butyl 4,7-diazaspiro(2.5)octane-7-carboxylate

C11H20N2O2CAS 886766-28-5212.29 g/mol

Open in Covalent MOL file
OONNH
CarbamateSecondary amine

Properties

Molecular formula
C11H20N2O2
Molar mass
212.29 g/mol
Exact mass
212.1525 Da
logP
1.36Crippen estimate
Polar surface area
41.6 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
0

Hazards

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

Identifiers

CAS number
886766-28-5
SMILES
CC(C)(C)OC(=O)N1CCNC2(C1)CC2
InChIKey
XXKCYKIJWLFVDG-UHFFFAOYSA-N
InChI
InChI=1S/C11H20N2O2/c1-10(2,3)15-9(14)13-7-6-12-11(8-13)4-5-11/h12H,4-8H2,1-3H3

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Names and synonyms

1 names
  • 4,7-Diaza-spiro[2.5]octane-7-carboxylic acid tert-butyl ester

Work with tert-Butyl 4,7-diazaspiro(2.5)octane-7-carboxylate

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

N-Boc-piperazine57260-71-661 % similar tert-Butyl 2,8-diazaspiro[4.5]decane-2-carboxylate336191-17-459 % similar tert-Butyl 2,6-diazaspiro(3.4)octane-6-carboxylate885270-86-056 % similar 2,7-Diaza-spiro[4.4]nonane-2-carboxylic acid tert-butyl ester236406-49-856 % similar tert-Butyl 1,4-diazepane-1-carboxylate112275-50-055 % similar 2-(tert-Butoxycarbonyl)-2,7-diazaspiro[3.5]nonane236406-55-655 % similar tert-Butyl 6-oxo-2,7-diazaspiro[4.4]nonane-2-carboxylate1194376-44-755 % similar tert-Butyl 3,9-diazaspiro[5.5]undecane-3-carboxylate173405-78-254 % similar

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

Same formula

tert-Butyl 6-amino-2-azaspiro[3.3]heptane-2-carboxylate1211586-09-2 tert-Butyl (7R)-5-azaspiro(2.4)heptan-7-ylcarbamate127199-44-4 (S)-tert-Butyl 5-azaspiro[2.4]heptan-7-ylcarbamate127199-45-5 Hexahydropyrrolo[3,4-c]pyrrole-2-carboxylic acid tert-butyl ester141449-85-6 tert-Butyl 3,8-diazabicyclo[3.2.1]octane-8-carboxylate149771-44-8 Hexahydro-pyrrolo[3,4-B]pyrrole-1-carboxylic acid tert-butyl ester185693-02-1 1,1-Dimethylethyl 3,8-diazabicyclo[3.2.1]octane-3-carboxylate201162-53-0 cis-2-Boc-hexahydropyrrolo[3,4-C]pyrrole250275-15-1

Elsewhere

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