Basic information
- Standard SMILES
CC(C)(C)OC(=O)N[C@H](CNCC(N)=O)CC1CCCCC1- InChIKey
RBWAFUHJGRJDAK-ZDUSSCGKSA-N- Molecular formula
- C16H31N3O3
- Average molar mass
- 313.44 g/mol
- Monoisotopic mass
- 313.23654186
Names & identifiers
- Preferred name
- tert-butyl (S)-1-(carbamoylmethylamino)-3-cyclohexyl-propan-2-ylcarbamate
- IUPAC
- tert-butyl N-[(2S)-1-[(2-amino-2-oxoethyl)amino]-3-cyclohexylpropan-2-yl]carbamate
Names & synonyms
SCHEMBL8271039RBWAFUHJGRJDAK-ZDUSSCGKSA-Ntert-butyl (S)-1-(carbamoylmethylamino)-3-cyclohexyl-propan-2-ylcarbamate
Database identifiers
- PubChem CID
- 57544928
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 93.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 360
Related reactions
2 records
Compound notes
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