(2-fluorophenyl)-pyridazin-4-ylmethanone

C11H7FN2O — CID 14360456

IUPAC(2-fluorophenyl)-pyridazin-4-ylmethanone
SMILESO=C(c1ccnnc1)c1ccccc1F
InChIInChI=1S/C11H7FN2O/c12-10-4-2-1-3-9(10)11(15)8-5-6-13-14-7-8/h1-7H
InChIKeyGTSZLDAZKWEJIK-UHFFFAOYSA-N
MW202.19 g/mol
LogP1.85
Rot. Bonds2

About (2-fluorophenyl)-pyridazin-4-ylmethanone

(2-fluorophenyl)-pyridazin-4-ylmethanone (PubChem CID 14360456) has the molecular formula C11H7FN2O and a molecular weight of 202.19 g/mol. Its IUPAC name is (2-fluorophenyl)-pyridazin-4-ylmethanone.

Molecular Properties

Compound Name(2-fluorophenyl)-pyridazin-4-ylmethanone
PubChem CID14360456
Molecular FormulaC11H7FN2O
Molecular Weight202.19 g/mol
Exact Mass202.05
IUPAC Name(2-fluorophenyl)-pyridazin-4-ylmethanone
SMILESO=C(c1ccnnc1)c1ccccc1F
InChIInChI=1S/C11H7FN2O/c12-10-4-2-1-3-9(10)11(15)8-5-6-13-14-7-8/h1-7H
InChIKeyGTSZLDAZKWEJIK-UHFFFAOYSA-N
XLogP1.85
TPSA42.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.19
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2-fluorophenyl)-pyridazin-4-ylmethanone?
The IUPAC name of (2-fluorophenyl)-pyridazin-4-ylmethanone (CID 14360456) is (2-fluorophenyl)-pyridazin-4-ylmethanone.
What is the SMILES notation for (2-fluorophenyl)-pyridazin-4-ylmethanone?
The canonical SMILES for (2-fluorophenyl)-pyridazin-4-ylmethanone is O=C(c1ccnnc1)c1ccccc1F.
What is the InChIKey of (2-fluorophenyl)-pyridazin-4-ylmethanone?
The InChIKey is GTSZLDAZKWEJIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7FN2O/c12-10-4-2-1-3-9(10)11(15)8-5-6-13-14-7-8/h1-7H.
What are the key properties of (2-fluorophenyl)-pyridazin-4-ylmethanone?
(2-fluorophenyl)-pyridazin-4-ylmethanone has a molecular weight of 202.19 g/mol, XLogP of 1.85, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluorophenyl)-pyridazin-4-ylmethanone is sourced from PubChem (CID 14360456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).