1-(4-fluorophenoxy)phthalazine

C14H9FN2O — CID 6410697

IUPAC1-(4-fluorophenoxy)phthalazine
SMILESFc1ccc(Oc2nncc3ccccc23)cc1
InChIInChI=1S/C14H9FN2O/c15-11-5-7-12(8-6-11)18-14-13-4-2-1-3-10(13)9-16-17-14/h1-9H
InChIKeyJEVRLJZTZLXJMB-UHFFFAOYSA-N
MW240.24 g/mol
LogP3.56
Rot. Bonds2

About 1-(4-fluorophenoxy)phthalazine

1-(4-fluorophenoxy)phthalazine (PubChem CID 6410697) has the molecular formula C14H9FN2O and a molecular weight of 240.24 g/mol. Its IUPAC name is 1-(4-fluorophenoxy)phthalazine.

Molecular Properties

Compound Name1-(4-fluorophenoxy)phthalazine
PubChem CID6410697
Molecular FormulaC14H9FN2O
Molecular Weight240.24 g/mol
Exact Mass240.07
IUPAC Name1-(4-fluorophenoxy)phthalazine
SMILESFc1ccc(Oc2nncc3ccccc23)cc1
InChIInChI=1S/C14H9FN2O/c15-11-5-7-12(8-6-11)18-14-13-4-2-1-3-10(13)9-16-17-14/h1-9H
InChIKeyJEVRLJZTZLXJMB-UHFFFAOYSA-N
XLogP3.56
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.24
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenoxy)phthalazine?
The IUPAC name of 1-(4-fluorophenoxy)phthalazine (CID 6410697) is 1-(4-fluorophenoxy)phthalazine.
What is the SMILES notation for 1-(4-fluorophenoxy)phthalazine?
The canonical SMILES for 1-(4-fluorophenoxy)phthalazine is Fc1ccc(Oc2nncc3ccccc23)cc1.
What is the InChIKey of 1-(4-fluorophenoxy)phthalazine?
The InChIKey is JEVRLJZTZLXJMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9FN2O/c15-11-5-7-12(8-6-11)18-14-13-4-2-1-3-10(13)9-16-17-14/h1-9H.
What are the key properties of 1-(4-fluorophenoxy)phthalazine?
1-(4-fluorophenoxy)phthalazine has a molecular weight of 240.24 g/mol, XLogP of 3.56, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenoxy)phthalazine is sourced from PubChem (CID 6410697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).