3-(4-fluoro-2-methoxyphenyl)-6-methoxypyridazine

C12H11FN2O2 — CID 56707609

IUPAC3-(4-fluoro-2-methoxyphenyl)-6-methoxypyridazine
SMILESCOc1ccc(-c2ccc(F)cc2OC)nn1
InChIInChI=1S/C12H11FN2O2/c1-16-11-7-8(13)3-4-9(11)10-5-6-12(17-2)15-14-10/h3-7H,1-2H3
InChIKeyYZQDKRNHPVIUNU-UHFFFAOYSA-N
MW234.23 g/mol
LogP2.30
Rot. Bonds3

About 3-(4-fluoro-2-methoxyphenyl)-6-methoxypyridazine

3-(4-fluoro-2-methoxyphenyl)-6-methoxypyridazine (PubChem CID 56707609) has the molecular formula C12H11FN2O2 and a molecular weight of 234.23 g/mol. Its IUPAC name is 3-(4-fluoro-2-methoxyphenyl)-6-methoxypyridazine.

Molecular Properties

Compound Name3-(4-fluoro-2-methoxyphenyl)-6-methoxypyridazine
PubChem CID56707609
Molecular FormulaC12H11FN2O2
Molecular Weight234.23 g/mol
Exact Mass234.08
IUPAC Name3-(4-fluoro-2-methoxyphenyl)-6-methoxypyridazine
SMILESCOc1ccc(-c2ccc(F)cc2OC)nn1
InChIInChI=1S/C12H11FN2O2/c1-16-11-7-8(13)3-4-9(11)10-5-6-12(17-2)15-14-10/h3-7H,1-2H3
InChIKeyYZQDKRNHPVIUNU-UHFFFAOYSA-N
XLogP2.30
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.23
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(4-fluoro-2-methoxyphenyl)-6-methoxypyridazine?
The IUPAC name of 3-(4-fluoro-2-methoxyphenyl)-6-methoxypyridazine (CID 56707609) is 3-(4-fluoro-2-methoxyphenyl)-6-methoxypyridazine.
What is the SMILES notation for 3-(4-fluoro-2-methoxyphenyl)-6-methoxypyridazine?
The canonical SMILES for 3-(4-fluoro-2-methoxyphenyl)-6-methoxypyridazine is COc1ccc(-c2ccc(F)cc2OC)nn1.
What is the InChIKey of 3-(4-fluoro-2-methoxyphenyl)-6-methoxypyridazine?
The InChIKey is YZQDKRNHPVIUNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11FN2O2/c1-16-11-7-8(13)3-4-9(11)10-5-6-12(17-2)15-14-10/h3-7H,1-2H3.
What are the key properties of 3-(4-fluoro-2-methoxyphenyl)-6-methoxypyridazine?
3-(4-fluoro-2-methoxyphenyl)-6-methoxypyridazine has a molecular weight of 234.23 g/mol, XLogP of 2.30, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluoro-2-methoxyphenyl)-6-methoxypyridazine is sourced from PubChem (CID 56707609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).