Basic information
- Standard SMILES
CC(C)(C)OC(=O)NC1CCN(CC2CS2)CC1- InChIKey
NNRZNOGUFIELQN-UHFFFAOYSA-N- Molecular formula
- C13H24N2O2S
- Average molar mass
- 272.41 g/mol
Names & identifiers
- Preferred name
- (1-Thiiranylmethyl-piperidin-4-yl)-carbamic acid tert-butyl ester
- IUPAC
- tert-butyl N-[1-(thiiran-2-ylmethyl)piperidin-4-yl]carbamate
Names & synonyms
SCHEMBL621578NNRZNOGUFIELQN-UHFFFAOYSA-N(1-thiiranylmethyl-piperidin-4-yl)-carbamic acid tert-butyl ester
Database identifiers
- PubChem CID
- 86662008
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 66.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 296
Related reactions
6 records
Compound notes
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