1,2-Diazaspiro[2.5]octane

C₆H₁₂N₂CAS 185-79-5112.18 g/mol

Open in Covalent MOL file

Secondary amine

Properties

Molecular formula: C₆H₁₂N₂
Molar mass: 112.18 g/mol
Exact mass: 112.1000 Da
logP: 0.75Crippen estimate
Polar surface area: 43.9 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 0

Identifiers

CAS number

185-79-5

SMILES

C1CCC2(CC1)NN2

InChIKey

LYDKTPRIAYMOIB-UHFFFAOYSA-N

InChI

InChI=1S/C6H12N2/c1-2-4-6(5-3-1)7-8-6/h7-8H,1-5H2

Weigh it out

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

Names and synonyms

4 names

1,2-Diazaspiro(2.5)octane
3,3-Pentamethylenediaziridine
1,2-Diazaspiro[2.5]octan
3.3-Pentamethylen-diaziridin

Work with 1,2-Diazaspiro[2.5]octane

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-Dimethylcyclohexane590-66-933 % similar

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

Same formula

2-Amino-2,3-dimethylbutanenitrile13893-53-3 Dabco280-57-9 2-(Diethylamino)acetonitrile3010-02-4 1,4,5,6-Tetrahydro-1,2-dimethylpyrimidine4271-96-9

Elsewhere

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