(3-fluorophenyl)-(6-methoxypyridazin-3-yl)methanol

C12H11FN2O2 — CID 103373450

IUPAC(3-fluorophenyl)-(6-methoxypyridazin-3-yl)methanol
SMILESCOc1ccc(C(O)c2cccc(F)c2)nn1
InChIInChI=1S/C12H11FN2O2/c1-17-11-6-5-10(14-15-11)12(16)8-3-2-4-9(13)7-8/h2-7,12,16H,1H3
InChIKeyXKHUBURLWVKACH-UHFFFAOYSA-N
MW234.23 g/mol
LogP1.71
Rot. Bonds3

About (3-fluorophenyl)-(6-methoxypyridazin-3-yl)methanol

(3-fluorophenyl)-(6-methoxypyridazin-3-yl)methanol (PubChem CID 103373450) has the molecular formula C12H11FN2O2 and a molecular weight of 234.23 g/mol. Its IUPAC name is (3-fluorophenyl)-(6-methoxypyridazin-3-yl)methanol.

Molecular Properties

Compound Name(3-fluorophenyl)-(6-methoxypyridazin-3-yl)methanol
PubChem CID103373450
Molecular FormulaC12H11FN2O2
Molecular Weight234.23 g/mol
Exact Mass234.08
IUPAC Name(3-fluorophenyl)-(6-methoxypyridazin-3-yl)methanol
SMILESCOc1ccc(C(O)c2cccc(F)c2)nn1
InChIInChI=1S/C12H11FN2O2/c1-17-11-6-5-10(14-15-11)12(16)8-3-2-4-9(13)7-8/h2-7,12,16H,1H3
InChIKeyXKHUBURLWVKACH-UHFFFAOYSA-N
XLogP1.71
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.23
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(4-Fluorophenyl)methyl]-6-methoxypyridazine
CID 45276200
[3-(6-Methoxypyridazin-3-yl)phenyl]methanol
CID 53425314
(6-Methoxypyridazin-3-yl)-phenylmethanol
CID 10036246
3-Methoxy-6-phenylpyridazine
CID 11084567
3-Methoxy-6-(4-methoxyphenyl)pyridazine
CID 15445189
3-Methoxy-6-(2-methoxyphenyl)pyridazine
CID 58838917
3-(2-Fluoro-6-isopropoxyphenyl)-6-methylpyridazine
CID 56706735
3-(4-Fluoro-2-methoxyphenyl)-6-methoxypyridazine
CID 56707609
[2-Fluoro-5-(6-methoxypyridazin-3-yl)phenyl]methanol
CID 56708792
(2S)-1-(5,6-dimethylpyridazin-3-yl)oxy-3-phenylmethoxypropan-2-ol
CID 97565739
(1R)-1-(3,5-dimethylphenyl)-2-(5,6-dimethylpyridazin-3-yl)oxyethanol
CID 124224820
3-[4-(Trifluoromethyl)phenyl]-6-methoxypyridazine
CID 16743327

Frequently Asked Questions

What is the IUPAC name of (3-fluorophenyl)-(6-methoxypyridazin-3-yl)methanol?
The IUPAC name of (3-fluorophenyl)-(6-methoxypyridazin-3-yl)methanol (CID 103373450) is (3-fluorophenyl)-(6-methoxypyridazin-3-yl)methanol.
What is the SMILES notation for (3-fluorophenyl)-(6-methoxypyridazin-3-yl)methanol?
The canonical SMILES for (3-fluorophenyl)-(6-methoxypyridazin-3-yl)methanol is COc1ccc(C(O)c2cccc(F)c2)nn1.
What is the InChIKey of (3-fluorophenyl)-(6-methoxypyridazin-3-yl)methanol?
The InChIKey is XKHUBURLWVKACH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11FN2O2/c1-17-11-6-5-10(14-15-11)12(16)8-3-2-4-9(13)7-8/h2-7,12,16H,1H3.
What are the key properties of (3-fluorophenyl)-(6-methoxypyridazin-3-yl)methanol?
(3-fluorophenyl)-(6-methoxypyridazin-3-yl)methanol has a molecular weight of 234.23 g/mol, XLogP of 1.71, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluorophenyl)-(6-methoxypyridazin-3-yl)methanol is sourced from PubChem (CID 103373450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).