Basic information
- Standard SMILES
COc1ccc([N+](=O)[O-])c(CNCC(O)CO)n1- InChIKey
LQMNQLIPIHKWNW-UHFFFAOYSA-N- Molecular formula
- C10H15N3O5
- Average molar mass
- 257.24 g/mol
Names & identifiers
- Preferred name
- 3-[(6-Methoxy-3-nitro-2-pyridyl)methylamino]propane-1,2-diol
- IUPAC
- 3-[(6-methoxy-3-nitro-2-pyridinyl)methylamino]propane-1,2-diol
Names & synonyms
SCHEMBL5363195LQMNQLIPIHKWNW-UHFFFAOYSA-N3-[(6-methoxy-3-nitro-2-pyridyl)methylamino]propane-1,2-diol3-[(6-methoxy-3-nitro-2-pyridyl)methyl-amino]propane-1,2-diol
Database identifiers
- PubChem CID
- 69417505
Properties
Computed structural properties
- XLogP
- -0.9
- Topological polar surface area
- 120 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 260
Related reactions
2 records
Compound notes
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