Basic information
- Standard SMILES
CCOC(=O)CN1CCN(C(C)(C)C=O)CC1- InChIKey
YFCTUHXUYHUBOQ-UHFFFAOYSA-N- Molecular formula
- C12H22N2O3
- Average molar mass
- 242.31 g/mol
Names & identifiers
- Preferred name
- Ethyl [4-(1,1-Dimethyl-2-oxo-ethyl)-piperazin-1-yl]-acetate
- IUPAC
- ethyl 2-[4-(2-methyl-1-oxopropan-2-yl)piperazin-1-yl]acetate
Names & synonyms
SCHEMBL1418049YFCTUHXUYHUBOQ-UHFFFAOYSA-NEthyl [4-(1,1-Dimethyl-2-oxo-ethyl)-piperazin-1-yl]-acetate
Database identifiers
- PubChem CID
- 54505093
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 49.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 271
Related reactions
2 records
Linked notes
Loading…