Basic information
- Standard SMILES
O=[N+]([O-])c1cnccc1NCCCO- InChIKey
XBOBNQSBAYDAKN-UHFFFAOYSA-N- Molecular formula
- C8H11N3O3
- Average molar mass
- 197.19 g/mol
Names & identifiers
- Preferred name
- 4-(3-Hydroxypropylamino)-3-nitropyridine
- IUPAC
- 3-[(3-nitro-4-pyridinyl)amino]propan-1-ol
Names & synonyms
3-[3'-Nitro-4'-pyridylamin]propanol-1SCHEMBL88848384-(3-hydroxypropylamino)-3-nitropyridine3-[(3-Nitro-4-pyridinyl)amino]-1-propanol #
Database identifiers
- PubChem CID
- 592330
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 91 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 183
Related reactions
6 records
Compound notes
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