Basic information
- Standard SMILES
C=CCC(NC(=O)OC(C)(C)C)C(=O)N1C(CC=C)CCCC1C(=O)OC- InChIKey
WSTZGUKICCXMGH-UHFFFAOYSA-N- Molecular formula
- C20H32N2O5
- Average molar mass
- 380.5 g/mol
- Monoisotopic mass
- 380.23112213
Names & identifiers
- Preferred name
- 6-allyl-1-(2-tert-butoxycarbonylamino-pent-4-enoyl)-piperidine-2-carboxylic Acid Methyl Ester
- IUPAC
- methyl 1-[2-[(2-methylpropan-2-yl)oxycarbonylamino]pent-4-enoyl]-6-prop-2-enylpiperidine-2-carboxylate
Names & synonyms
SCHEMBL6088607WSTZGUKICCXMGH-UHFFFAOYSA-N6-allyl-1-(2-tert-butoxycarbonylamino-pent-4-enoyl)-piperidine-2-carboxylic Acid Methyl Ester
Database identifiers
- PubChem CID
- 69659809
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 84.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 10
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 567
Related reactions
4 records
Compound notes
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