Basic information
- Standard SMILES
CCC(CC)(CN1CCC(CNC(=O)OC(C)(C)C)CC1)C(=O)OC- InChIKey
BPKABWRKQHBVNL-UHFFFAOYSA-N- Molecular formula
- C19H36N2O4
- Average molar mass
- 356.5 g/mol
Names & identifiers
- Preferred name
- Methyl 2-[(4-{[(tert-butoxycarbonyl)amino]methyl}piperidin-1-yl)methyl]-2-ethylbutanoate
- IUPAC
- methyl 2-ethyl-2-[[4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]piperidin-1-yl]methyl]butanoate
Names & synonyms
SCHEMBL1970440BPKABWRKQHBVNL-UHFFFAOYSA-NMethyl 2-[(4-{[(tert-butoxycarbonyl)amino]methyl}piperidin-1-yl)methyl]-2-ethylbutanoateMethyl 2-[(4{[(tert-butoxycarbonyl)amino]methyl}piperidin-1-yl)methyl]-2-ethylbutanoate
Database identifiers
- PubChem CID
- 67232103
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 67.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 10
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 433
Related reactions
3 records
Linked notes
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