4-[(E)-2-(2-fluorophenyl)ethenyl]pyridazine

C12H9FN2 — CID 6327980

IUPAC4-[(E)-2-(2-fluorophenyl)ethenyl]pyridazine
SMILESFc1ccccc1/C=C/c1ccnnc1
InChIInChI=1S/C12H9FN2/c13-12-4-2-1-3-11(12)6-5-10-7-8-14-15-9-10/h1-9H/b6-5+
InChIKeyVTISJDDEAHTGQV-AATRIKPKSA-N
MW200.22 g/mol
LogP2.79
Rot. Bonds2

About 4-[(E)-2-(2-fluorophenyl)ethenyl]pyridazine

4-[(E)-2-(2-fluorophenyl)ethenyl]pyridazine (PubChem CID 6327980) has the molecular formula C12H9FN2 and a molecular weight of 200.22 g/mol. Its IUPAC name is 4-[(E)-2-(2-fluorophenyl)ethenyl]pyridazine.

Molecular Properties

Compound Name4-[(E)-2-(2-fluorophenyl)ethenyl]pyridazine
PubChem CID6327980
Molecular FormulaC12H9FN2
Molecular Weight200.22 g/mol
Exact Mass200.07
IUPAC Name4-[(E)-2-(2-fluorophenyl)ethenyl]pyridazine
SMILESFc1ccccc1/C=C/c1ccnnc1
InChIInChI=1S/C12H9FN2/c13-12-4-2-1-3-11(12)6-5-10-7-8-14-15-9-10/h1-9H/b6-5+
InChIKeyVTISJDDEAHTGQV-AATRIKPKSA-N
XLogP2.79
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.22
LogP ≤ 52.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[(E)-2-(2-fluorophenyl)ethenyl]pyridazine?
The IUPAC name of 4-[(E)-2-(2-fluorophenyl)ethenyl]pyridazine (CID 6327980) is 4-[(E)-2-(2-fluorophenyl)ethenyl]pyridazine.
What is the SMILES notation for 4-[(E)-2-(2-fluorophenyl)ethenyl]pyridazine?
The canonical SMILES for 4-[(E)-2-(2-fluorophenyl)ethenyl]pyridazine is Fc1ccccc1/C=C/c1ccnnc1.
What is the InChIKey of 4-[(E)-2-(2-fluorophenyl)ethenyl]pyridazine?
The InChIKey is VTISJDDEAHTGQV-AATRIKPKSA-N. The full InChI is InChI=1S/C12H9FN2/c13-12-4-2-1-3-11(12)6-5-10-7-8-14-15-9-10/h1-9H/b6-5+.
What are the key properties of 4-[(E)-2-(2-fluorophenyl)ethenyl]pyridazine?
4-[(E)-2-(2-fluorophenyl)ethenyl]pyridazine has a molecular weight of 200.22 g/mol, XLogP of 2.79, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(E)-2-(2-fluorophenyl)ethenyl]pyridazine is sourced from PubChem (CID 6327980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).