Basic information
- CAS
65540-58-1- Standard SMILES
CN(C)c1ccc(N[C@@H](CCC(N)=O)C(=O)O)cc1- InChIKey
BQDJKYIUFIEQSY-NSHDSACASA-N- Molecular formula
- C13H19N3O3
- Average molar mass
- 265.31 g/mol
- Monoisotopic mass
- 265.14264148
Names & identifiers
- Preferred name
- N~2~-[4-(Dimethylamino)phenyl]-L-glutamine
- IUPAC
- (2S)-5-amino-2-[4-(dimethylamino)anilino]-5-oxopentanoic acid
Names & synonyms
65540-58-1N~2~-[4-(Dimethylamino)phenyl]-L-glutamineDTXSID70798407
Database identifiers
- CAS
65540-58-1- PubChem CID
- 71375673
- DTXSID
DTXSID70798407
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 95.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 312
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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