Basic information
- CAS
24326-08-7- Standard SMILES
C[C@H](N)C(=O)N[C@@H](C)C(N)=O- InChIKey
DFQJATWYPJPAEU-IMJSIDKUSA-N- Molecular formula
- C6H13N3O2
- Average molar mass
- 159.19 g/mol
- Monoisotopic mass
- 159.10077667
Names & identifiers
- Preferred name
- Alanyl-l-alaninamide
- IUPAC
- (2S)-2-amino-N-[(2S)-1-amino-1-oxopropan-2-yl]propanamide
Names & synonyms
alanyl-l-alaninamide24326-08-7DTXSID40427434RefChem:318026DTXCID70378268l-alanyl-l-alaninamideSafinamide Impurity RSCHEMBL1259207SCHEMBL6578415(S)-2-Amino-N-((S)-1-amino-1-oxopropan-2-yl)propanamide
Database identifiers
- CAS
24326-08-7- PubChem CID
- 7022326
- DTXSID
DTXSID40427434- Nikkaji
- J940.846K
Properties
Computed structural properties
- XLogP
- -2.3
- Topological polar surface area
- 98.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 169
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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