2-(2-fluorophenoxy)-3-nitropyridine

C11H7FN2O3 — CID 2737457

IUPAC2-(2-fluorophenoxy)-3-nitropyridine
SMILESO=[N+]([O-])c1cccnc1Oc1ccccc1F
InChIInChI=1S/C11H7FN2O3/c12-8-4-1-2-6-10(8)17-11-9(14(15)16)5-3-7-13-11/h1-7H
InChIKeyBWWQVVFSTXRVGB-UHFFFAOYSA-N
MW234.19 g/mol
LogP2.92
Rot. Bonds3

About 2-(2-fluorophenoxy)-3-nitropyridine

2-(2-fluorophenoxy)-3-nitropyridine (PubChem CID 2737457) has the molecular formula C11H7FN2O3 and a molecular weight of 234.19 g/mol. Its IUPAC name is 2-(2-fluorophenoxy)-3-nitropyridine.

Molecular Properties

Compound Name2-(2-fluorophenoxy)-3-nitropyridine
PubChem CID2737457
Molecular FormulaC11H7FN2O3
Molecular Weight234.19 g/mol
Exact Mass234.04
IUPAC Name2-(2-fluorophenoxy)-3-nitropyridine
SMILESO=[N+]([O-])c1cccnc1Oc1ccccc1F
InChIInChI=1S/C11H7FN2O3/c12-8-4-1-2-6-10(8)17-11-9(14(15)16)5-3-7-13-11/h1-7H
InChIKeyBWWQVVFSTXRVGB-UHFFFAOYSA-N
XLogP2.92
TPSA65.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.19
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenoxy)-3-nitropyridine?
The IUPAC name of 2-(2-fluorophenoxy)-3-nitropyridine (CID 2737457) is 2-(2-fluorophenoxy)-3-nitropyridine.
What is the SMILES notation for 2-(2-fluorophenoxy)-3-nitropyridine?
The canonical SMILES for 2-(2-fluorophenoxy)-3-nitropyridine is O=[N+]([O-])c1cccnc1Oc1ccccc1F.
What is the InChIKey of 2-(2-fluorophenoxy)-3-nitropyridine?
The InChIKey is BWWQVVFSTXRVGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7FN2O3/c12-8-4-1-2-6-10(8)17-11-9(14(15)16)5-3-7-13-11/h1-7H.
What are the key properties of 2-(2-fluorophenoxy)-3-nitropyridine?
2-(2-fluorophenoxy)-3-nitropyridine has a molecular weight of 234.19 g/mol, XLogP of 2.92, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenoxy)-3-nitropyridine is sourced from PubChem (CID 2737457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).