Basic information
- Standard SMILES
CC(C)(C)OC(=O)NCCC[C@@H](CN)NC(=O)OC(C)(C)C- InChIKey
IXCAVSIBYPQLGV-NSHDSACASA-N- Molecular formula
- C15H31N3O4
- Average molar mass
- 317.42 g/mol
- Monoisotopic mass
- 317.23145648
Names & identifiers
- Preferred name
- tert-Butyl {(4S)-5-amino-4-[(tert-butoxycarbonyl)amino]pentyl}carbamate
- IUPAC
- tert-butyl N-[(2S)-1-amino-5-[(2-methylpropan-2-yl)oxycarbonylamino]pentan-2-yl]carbamate
Names & synonyms
SCHEMBL12667478IXCAVSIBYPQLGV-NSHDSACASA-Ntert-Butyl {(4S)-5-amino-4-[(tert-butoxycarbonyl)amino]pentyl}-carbamatetert-Butyl {(4S)-5-amino-4-[(tert-butoxycarbonyl)amino]pentyl}carbamatetert-butyl{(4s)-5-amino-4-[(tert-butoxycarbonyl)amino]pentyl}carbamate
Database identifiers
- PubChem CID
- 57440197
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 103 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 10
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 359
Related reactions
9 records
Compound notes
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