1-[(4-fluorophenyl)methoxy]phthalazine

C15H11FN2O — CID 78767267

IUPAC1-[(4-fluorophenyl)methoxy]phthalazine
SMILESFc1ccc(COc2nncc3ccccc23)cc1
InChIInChI=1S/C15H11FN2O/c16-13-7-5-11(6-8-13)10-19-15-14-4-2-1-3-12(14)9-17-18-15/h1-9H,10H2
InChIKeyCAKCQXKXFQKQHT-UHFFFAOYSA-N
MW254.26 g/mol
LogP3.35
Rot. Bonds3

About 1-[(4-fluorophenyl)methoxy]phthalazine

1-[(4-fluorophenyl)methoxy]phthalazine (PubChem CID 78767267) has the molecular formula C15H11FN2O and a molecular weight of 254.26 g/mol. Its IUPAC name is 1-[(4-fluorophenyl)methoxy]phthalazine.

Molecular Properties

Compound Name1-[(4-fluorophenyl)methoxy]phthalazine
PubChem CID78767267
Molecular FormulaC15H11FN2O
Molecular Weight254.26 g/mol
Exact Mass254.09
IUPAC Name1-[(4-fluorophenyl)methoxy]phthalazine
SMILESFc1ccc(COc2nncc3ccccc23)cc1
InChIInChI=1S/C15H11FN2O/c16-13-7-5-11(6-8-13)10-19-15-14-4-2-1-3-12(14)9-17-18-15/h1-9H,10H2
InChIKeyCAKCQXKXFQKQHT-UHFFFAOYSA-N
XLogP3.35
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.26
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[(4-fluorophenyl)methoxy]phthalazine?
The IUPAC name of 1-[(4-fluorophenyl)methoxy]phthalazine (CID 78767267) is 1-[(4-fluorophenyl)methoxy]phthalazine.
What is the SMILES notation for 1-[(4-fluorophenyl)methoxy]phthalazine?
The canonical SMILES for 1-[(4-fluorophenyl)methoxy]phthalazine is Fc1ccc(COc2nncc3ccccc23)cc1.
What is the InChIKey of 1-[(4-fluorophenyl)methoxy]phthalazine?
The InChIKey is CAKCQXKXFQKQHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11FN2O/c16-13-7-5-11(6-8-13)10-19-15-14-4-2-1-3-12(14)9-17-18-15/h1-9H,10H2.
What are the key properties of 1-[(4-fluorophenyl)methoxy]phthalazine?
1-[(4-fluorophenyl)methoxy]phthalazine has a molecular weight of 254.26 g/mol, XLogP of 3.35, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-fluorophenyl)methoxy]phthalazine is sourced from PubChem (CID 78767267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).