2-[(4-fluorophenyl)methyl]-6-(furan-2-yl)pyridazin-3-one

C15H11FN2O2 — CID 7658268

IUPAC2-[(4-fluorophenyl)methyl]-6-(furan-2-yl)pyridazin-3-one
SMILESO=c1ccc(-c2ccco2)nn1Cc1ccc(F)cc1
InChIInChI=1S/C15H11FN2O2/c16-12-5-3-11(4-6-12)10-18-15(19)8-7-13(17-18)14-2-1-9-20-14/h1-9H,10H2
InChIKeyHSJROGZNTFEQLQ-UHFFFAOYSA-N
MW270.26 g/mol
LogP2.69
Rot. Bonds3

About 2-[(4-fluorophenyl)methyl]-6-(furan-2-yl)pyridazin-3-one

2-[(4-fluorophenyl)methyl]-6-(furan-2-yl)pyridazin-3-one (PubChem CID 7658268) has the molecular formula C15H11FN2O2 and a molecular weight of 270.26 g/mol. Its IUPAC name is 2-[(4-fluorophenyl)methyl]-6-(furan-2-yl)pyridazin-3-one.

Molecular Properties

Compound Name2-[(4-fluorophenyl)methyl]-6-(furan-2-yl)pyridazin-3-one
PubChem CID7658268
Molecular FormulaC15H11FN2O2
Molecular Weight270.26 g/mol
Exact Mass270.08
IUPAC Name2-[(4-fluorophenyl)methyl]-6-(furan-2-yl)pyridazin-3-one
SMILESO=c1ccc(-c2ccco2)nn1Cc1ccc(F)cc1
InChIInChI=1S/C15H11FN2O2/c16-12-5-3-11(4-6-12)10-18-15(19)8-7-13(17-18)14-2-1-9-20-14/h1-9H,10H2
InChIKeyHSJROGZNTFEQLQ-UHFFFAOYSA-N
XLogP2.69
TPSA48.03 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.26
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-fluorophenyl)methyl]-6-(furan-2-yl)pyridazin-3-one?
The IUPAC name of 2-[(4-fluorophenyl)methyl]-6-(furan-2-yl)pyridazin-3-one (CID 7658268) is 2-[(4-fluorophenyl)methyl]-6-(furan-2-yl)pyridazin-3-one.
What is the SMILES notation for 2-[(4-fluorophenyl)methyl]-6-(furan-2-yl)pyridazin-3-one?
The canonical SMILES for 2-[(4-fluorophenyl)methyl]-6-(furan-2-yl)pyridazin-3-one is O=c1ccc(-c2ccco2)nn1Cc1ccc(F)cc1.
What is the InChIKey of 2-[(4-fluorophenyl)methyl]-6-(furan-2-yl)pyridazin-3-one?
The InChIKey is HSJROGZNTFEQLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11FN2O2/c16-12-5-3-11(4-6-12)10-18-15(19)8-7-13(17-18)14-2-1-9-20-14/h1-9H,10H2.
What are the key properties of 2-[(4-fluorophenyl)methyl]-6-(furan-2-yl)pyridazin-3-one?
2-[(4-fluorophenyl)methyl]-6-(furan-2-yl)pyridazin-3-one has a molecular weight of 270.26 g/mol, XLogP of 2.69, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-fluorophenyl)methyl]-6-(furan-2-yl)pyridazin-3-one is sourced from PubChem (CID 7658268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).