tert-Butyl 6-oxo-2-azaspiro(3.3)heptane-2-carboxylate

C₁₁H₁₇NO₃CAS 1181816-12-5211.26 g/mol

Open in Covalent MOL file

Carbamate Ketone

Properties

Molecular formula: C₁₁H₁₇NO₃
Molar mass: 211.26 g/mol
Exact mass: 211.1208 Da
logP: 1.59Crippen estimate
Polar surface area: 46.6 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 0

Identifiers

CAS number

1181816-12-5

SMILES

CC(C)(C)OC(=O)N1CC2(C1)CC(=O)C2

InChIKey

HQHRAGXKFOTSQE-UHFFFAOYSA-N

InChI

InChI=1S/C11H17NO3/c1-10(2,3)15-9(14)12-6-11(7-12)4-8(13)5-11/h4-7H2,1-3H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names

tert-Butyl 6-oxo-2-azaspiro[3.3]heptane-2-carboxylate

Work with tert-Butyl 6-oxo-2-azaspiro(3.3)heptane-2-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

1,1-Dimethylethyl 2,6-diazaspiro[3.3]heptane-2-carboxylate1041026-70-365 % similar tert-Butyl 3-oxoazetidine-1-carboxylate398489-26-463 % similar tert-Butyl 6-hydroxy-2-azaspiro[3.3]heptane-2-carboxylate1147557-97-859 % similar tert-Butyl 6-amino-2-azaspiro[3.3]heptane-2-carboxylate1211586-09-259 % similar 1,1-Dimethylethyl 3,3-difluoro-1-azetidinecarboxylate1255666-59-159 % similar tert-Butyl 4-oxopiperidine-1-carboxylate79099-07-359 % similar 1,1-Dimethylethyl 7-oxo-2,6-diazaspiro[3.4]octane-2-carboxylate1234616-51-357 % similar 3-Hydroxy-3-methyl-azetidine-1-carboxylic acid tert-butyl ester1104083-23-957 % similar

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

Same formula

4-(3-Methoxypropoxy)-3-methyl-2-pyridinemethanol118175-10-3 1,1-Dimethylethyl 5-oxo-2-azabicyclo[2.2.1]heptane-2-carboxylate198835-06-2 Diethylamine salicylate4419-92-5 Metaproterenol586-06-1 Isoproterenol7683-59-2

Elsewhere

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