Basic information
- Standard SMILES
Cn1cc(-c2cc(Oc3ccc([N+](=O)[O-])nc3)ccn2)cn1- InChIKey
UVEBGIWHYZTCAF-UHFFFAOYSA-N- Molecular formula
- C14H11N5O3
- Average molar mass
- 297.27 g/mol
Names & identifiers
- Preferred name
- 2-(1-Methyl-1h-pyrazol-4-yl)-4-[(6-nitro-3-pyridinyl)oxy]pyridine
- IUPAC
- 5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-nitropyridine
Names & synonyms
SCHEMBL16028387SCHEMBL30086819UVEBGIWHYZTCAF-UHFFFAOYSA-NDB-1913942-(1-methyl-1H-pyrazol-4-yl)-4-((6-nitropyridin-3-yl)oxy)pyridine2-(1-Methyl-1h-pyrazol-4-yl)-4-[(6-nitro-3-pyridinyl)oxy]pyridine1628182-83-1
Database identifiers
- PubChem CID
- 90402941
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 98.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 391
Related reactions
5 records
Compound notes
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