Basic information
- CAS
490-41-5- Standard SMILES
CNCCc1cn(C2OC(CO)C(O)C(O)C2O)cn1- InChIKey
OEKQERNSGNPOQB-UHFFFAOYSA-N- Molecular formula
- C12H21N3O5
- Average molar mass
- 287.31 g/mol
- Monoisotopic mass
- 287.14812078
Names & identifiers
- Preferred name
- 1-Hexopyranosyl-4-[2-(methylamino)ethyl]-1h-imidazole
- IUPAC
- 2-(hydroxymethyl)-6-[4-[2-(methylamino)ethyl]imidazol-1-yl]oxane-3,4,5-triol
Names & synonyms
490-41-51-hexopyranosyl-4-[2-(methylamino)ethyl]-1h-imidazoleNSC131922DTXSID10299665NSC-131922
Database identifiers
- CAS
490-41-5- PubChem CID
- 280335
- DTXSID
DTXSID10299665
Properties
Computed structural properties
- XLogP
- -2.3
- Topological polar surface area
- 120 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 309
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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