Basic information
- Standard SMILES
COC(=O)c1ccc(OCCN2CCN(C(=O)OC(C)(C)C)CC2)c(C)c1- InChIKey
FBWHECAMNYQLII-UHFFFAOYSA-N- Molecular formula
- C20H30N2O5
- Average molar mass
- 378.5 g/mol
Names & identifiers
- Preferred name
- 4-[2-(4-Methoxycarbonyl-2-methyl-phenoxy)-ethyl]-piperazine-1-carboxylic Acid Tert-butyl Ester
- IUPAC
- tert-butyl 4-[2-(4-methoxycarbonyl-2-methylphenoxy)ethyl]piperazine-1-carboxylate
Names & synonyms
SCHEMBL1495991FBWHECAMNYQLII-UHFFFAOYSA-N4-[2-(4-Methoxycarbonyl-2-methyl-phenoxy)-ethyl]-piperazine-1-carboxylic Acid Tert-butyl Ester
Database identifiers
- PubChem CID
- 57555264
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 68.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 497
Related reactions
3 records
Compound notes
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