chempirical

tert-Butyl 2,9-diazaspiro(5.5)undecane-9-carboxylate

C14H26N2O2CAS 1023595-19-8254.37 g/mol

Open in Covalent MOL file
OONNH
CarbamateSecondary amine

Properties

Molecular formula
C14H26N2O2
Molar mass
254.37 g/mol
Exact mass
254.1994 Da
logP
2.39Crippen estimate
Polar surface area
41.6 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
0

Identifiers

CAS number
1023595-19-8
SMILES
CC(C)(C)OC(=O)N1CCC2(CCCNC2)CC1
InChIKey
QDWTYWWOUAIWGI-UHFFFAOYSA-N
InChI
InChI=1S/C14H26N2O2/c1-13(2,3)18-12(17)16-9-6-14(7-10-16)5-4-8-15-11-14/h15H,4-11H2,1-3H3

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Names and synonyms

1 names
  • tert-Butyl 2,9-diazaspiro[5.5]undecane-9-carboxylate

Work with tert-Butyl 2,9-diazaspiro(5.5)undecane-9-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

tert-Butyl 2,7-diazaspiro(3.5)nonane-7-carboxylate hydrochloride1023301-84-970 % similar tert-Butyl 1,4-diazepane-1-carboxylate112275-50-063 % similar N-Boc-piperazine57260-71-661 % similar 1,1-Dimethylethyl 2-oxa-7-azaspiro[3.5]nonane-7-carboxylate240401-27-860 % similar 1,1-Dimethylethyl 2,6-diazaspiro[3.3]heptane-2-carboxylate1041026-70-357 % similar 1,1-Dimethylethyl 9-oxo-3-azaspiro[5.5]undecane-3-carboxylate873924-08-457 % similar 1,1-Dimethylethyl 1-pyrrolidinecarboxylate86953-79-957 % similar 1,1-Dimethylethyl 1-piperidinecarboxylate75844-69-855 % similar

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

Elsewhere

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