3-fluoro-6-phenylmethoxypyridazine

C11H9FN2O — CID 71405914

IUPAC3-fluoro-6-phenylmethoxypyridazine
SMILESFc1ccc(OCc2ccccc2)nn1
InChIInChI=1S/C11H9FN2O/c12-10-6-7-11(14-13-10)15-8-9-4-2-1-3-5-9/h1-7H,8H2
InChIKeyIWKTXEWKOWHYQW-UHFFFAOYSA-N
MW204.20 g/mol
LogP2.19
Rot. Bonds3

About 3-fluoro-6-phenylmethoxypyridazine

3-fluoro-6-phenylmethoxypyridazine (PubChem CID 71405914) has the molecular formula C11H9FN2O and a molecular weight of 204.20 g/mol. Its IUPAC name is 3-fluoro-6-phenylmethoxypyridazine.

Molecular Properties

Compound Name3-fluoro-6-phenylmethoxypyridazine
PubChem CID71405914
Molecular FormulaC11H9FN2O
Molecular Weight204.20 g/mol
Exact Mass204.07
IUPAC Name3-fluoro-6-phenylmethoxypyridazine
SMILESFc1ccc(OCc2ccccc2)nn1
InChIInChI=1S/C11H9FN2O/c12-10-6-7-11(14-13-10)15-8-9-4-2-1-3-5-9/h1-7H,8H2
InChIKeyIWKTXEWKOWHYQW-UHFFFAOYSA-N
XLogP2.19
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.20
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-6-phenylmethoxypyridazine?
The IUPAC name of 3-fluoro-6-phenylmethoxypyridazine (CID 71405914) is 3-fluoro-6-phenylmethoxypyridazine.
What is the SMILES notation for 3-fluoro-6-phenylmethoxypyridazine?
The canonical SMILES for 3-fluoro-6-phenylmethoxypyridazine is Fc1ccc(OCc2ccccc2)nn1.
What is the InChIKey of 3-fluoro-6-phenylmethoxypyridazine?
The InChIKey is IWKTXEWKOWHYQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9FN2O/c12-10-6-7-11(14-13-10)15-8-9-4-2-1-3-5-9/h1-7H,8H2.
What are the key properties of 3-fluoro-6-phenylmethoxypyridazine?
3-fluoro-6-phenylmethoxypyridazine has a molecular weight of 204.20 g/mol, XLogP of 2.19, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-6-phenylmethoxypyridazine is sourced from PubChem (CID 71405914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).