2-[4-[6-(hydroxymethyl)pyridazin-3-yl]oxyphenyl]ethanol

C13H14N2O3 — CID 107709782

IUPAC2-[4-[6-(hydroxymethyl)pyridazin-3-yl]oxyphenyl]ethanol
SMILESOCCc1ccc(Oc2ccc(CO)nn2)cc1
InChIInChI=1S/C13H14N2O3/c16-8-7-10-1-4-12(5-2-10)18-13-6-3-11(9-17)14-15-13/h1-6,16-17H,7-9H2
InChIKeyWYHJOQSXEXMMIV-UHFFFAOYSA-N
MW246.27 g/mol
LogP1.30
Rot. Bonds5

About 2-[4-[6-(hydroxymethyl)pyridazin-3-yl]oxyphenyl]ethanol

2-[4-[6-(hydroxymethyl)pyridazin-3-yl]oxyphenyl]ethanol (PubChem CID 107709782) has the molecular formula C13H14N2O3 and a molecular weight of 246.27 g/mol. Its IUPAC name is 2-[4-[6-(hydroxymethyl)pyridazin-3-yl]oxyphenyl]ethanol.

Molecular Properties

Compound Name2-[4-[6-(hydroxymethyl)pyridazin-3-yl]oxyphenyl]ethanol
PubChem CID107709782
Molecular FormulaC13H14N2O3
Molecular Weight246.27 g/mol
Exact Mass246.10
IUPAC Name2-[4-[6-(hydroxymethyl)pyridazin-3-yl]oxyphenyl]ethanol
SMILESOCCc1ccc(Oc2ccc(CO)nn2)cc1
InChIInChI=1S/C13H14N2O3/c16-8-7-10-1-4-12(5-2-10)18-13-6-3-11(9-17)14-15-13/h1-6,16-17H,7-9H2
InChIKeyWYHJOQSXEXMMIV-UHFFFAOYSA-N
XLogP1.30
TPSA75.47 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-[4-(2-hydroxyethyl)phenoxy]pyridine-3-carbothioamide
CID 107708868
[6-(4-bromo-3,5-dimethylphenoxy)pyridazin-3-yl]methanol
CID 107725618
[6-[(4-methoxyphenyl)methoxy]pyridazin-3-yl]methanol
CID 61257374
2-[6-(hydroxymethyl)pyridazin-3-yl]oxyethanol
CID 61256353
[6-(3-methyl-4-propan-2-ylphenoxy)pyridazin-3-yl]methanol
CID 61257121
2-[4-[(6-fluoro-2-pyridinyl)oxy]phenyl]ethanol
CID 107708756
2-[4-[(4-methyl-2-pyridinyl)oxy]phenyl]ethanol
CID 107709611
[6-(1-propylpyrazol-4-yl)oxypyridazin-3-yl]methanol
CID 116802649
(6-phenoxypyridazin-3-yl)methanamine
CID 62296458
[6-[(2-methylpropan-2-yl)oxy]pyridazin-3-yl]methanol
CID 61257369
3-(chloromethyl)-6-(4-iodophenoxy)pyridazine
CID 61269176
2-[4-(2-hydroxyethyl)phenoxy]-6-methylpyridine-4-carboxamide
CID 107709693

Frequently Asked Questions

What is the IUPAC name of 2-[4-[6-(hydroxymethyl)pyridazin-3-yl]oxyphenyl]ethanol?
The IUPAC name of 2-[4-[6-(hydroxymethyl)pyridazin-3-yl]oxyphenyl]ethanol (CID 107709782) is 2-[4-[6-(hydroxymethyl)pyridazin-3-yl]oxyphenyl]ethanol.
What is the SMILES notation for 2-[4-[6-(hydroxymethyl)pyridazin-3-yl]oxyphenyl]ethanol?
The canonical SMILES for 2-[4-[6-(hydroxymethyl)pyridazin-3-yl]oxyphenyl]ethanol is OCCc1ccc(Oc2ccc(CO)nn2)cc1.
What is the InChIKey of 2-[4-[6-(hydroxymethyl)pyridazin-3-yl]oxyphenyl]ethanol?
The InChIKey is WYHJOQSXEXMMIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O3/c16-8-7-10-1-4-12(5-2-10)18-13-6-3-11(9-17)14-15-13/h1-6,16-17H,7-9H2.
What are the key properties of 2-[4-[6-(hydroxymethyl)pyridazin-3-yl]oxyphenyl]ethanol?
2-[4-[6-(hydroxymethyl)pyridazin-3-yl]oxyphenyl]ethanol has a molecular weight of 246.27 g/mol, XLogP of 1.30, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[6-(hydroxymethyl)pyridazin-3-yl]oxyphenyl]ethanol is sourced from PubChem (CID 107709782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).