(4-fluoro-3-methylphenyl)-(6-methoxypyridazin-3-yl)methanol

C13H13FN2O2 — CID 103373465

IUPAC(4-fluoro-3-methylphenyl)-(6-methoxypyridazin-3-yl)methanol
SMILESCOc1ccc(C(O)c2ccc(F)c(C)c2)nn1
InChIInChI=1S/C13H13FN2O2/c1-8-7-9(3-4-10(8)14)13(17)11-5-6-12(18-2)16-15-11/h3-7,13,17H,1-2H3
InChIKeyWGXVKOTWIAAORL-UHFFFAOYSA-N
MW248.26 g/mol
LogP2.01
Rot. Bonds3

About (4-fluoro-3-methylphenyl)-(6-methoxypyridazin-3-yl)methanol

(4-fluoro-3-methylphenyl)-(6-methoxypyridazin-3-yl)methanol (PubChem CID 103373465) has the molecular formula C13H13FN2O2 and a molecular weight of 248.26 g/mol. Its IUPAC name is (4-fluoro-3-methylphenyl)-(6-methoxypyridazin-3-yl)methanol.

Molecular Properties

Compound Name(4-fluoro-3-methylphenyl)-(6-methoxypyridazin-3-yl)methanol
PubChem CID103373465
Molecular FormulaC13H13FN2O2
Molecular Weight248.26 g/mol
Exact Mass248.10
IUPAC Name(4-fluoro-3-methylphenyl)-(6-methoxypyridazin-3-yl)methanol
SMILESCOc1ccc(C(O)c2ccc(F)c(C)c2)nn1
InChIInChI=1S/C13H13FN2O2/c1-8-7-9(3-4-10(8)14)13(17)11-5-6-12(18-2)16-15-11/h3-7,13,17H,1-2H3
InChIKeyWGXVKOTWIAAORL-UHFFFAOYSA-N
XLogP2.01
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.26
LogP ≤ 52.01
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-(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
(1R)-1-(3,5-dimethylphenyl)-2-(5,6-dimethylpyridazin-3-yl)oxyethanol
CID 124224820
3-(4-Fluorophenyl)-6-methoxypyridazine
CID 16743682
4-Fluoro-3-methoxy-6-[3-(trifluoromethyl)phenyl]pyridazine
CID 19959682
(E)-2-fluoro-3-[4-(6-methoxypyridazin-3-yl)phenyl]prop-2-en-1-ol
CID 22631078
[4-[3-[6-(4-Fluorophenyl)pyridazin-3-yl]propoxy]phenyl]methanol
CID 69106291

Frequently Asked Questions

What is the IUPAC name of (4-fluoro-3-methylphenyl)-(6-methoxypyridazin-3-yl)methanol?
The IUPAC name of (4-fluoro-3-methylphenyl)-(6-methoxypyridazin-3-yl)methanol (CID 103373465) is (4-fluoro-3-methylphenyl)-(6-methoxypyridazin-3-yl)methanol.
What is the SMILES notation for (4-fluoro-3-methylphenyl)-(6-methoxypyridazin-3-yl)methanol?
The canonical SMILES for (4-fluoro-3-methylphenyl)-(6-methoxypyridazin-3-yl)methanol is COc1ccc(C(O)c2ccc(F)c(C)c2)nn1.
What is the InChIKey of (4-fluoro-3-methylphenyl)-(6-methoxypyridazin-3-yl)methanol?
The InChIKey is WGXVKOTWIAAORL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13FN2O2/c1-8-7-9(3-4-10(8)14)13(17)11-5-6-12(18-2)16-15-11/h3-7,13,17H,1-2H3.
What are the key properties of (4-fluoro-3-methylphenyl)-(6-methoxypyridazin-3-yl)methanol?
(4-fluoro-3-methylphenyl)-(6-methoxypyridazin-3-yl)methanol has a molecular weight of 248.26 g/mol, XLogP of 2.01, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluoro-3-methylphenyl)-(6-methoxypyridazin-3-yl)methanol is sourced from PubChem (CID 103373465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).