2-(2,5-difluorophenyl)-1-(6-methoxypyridazin-3-yl)ethanol

C13H12F2N2O2 — CID 103373403

IUPAC2-(2,5-difluorophenyl)-1-(6-methoxypyridazin-3-yl)ethanol
SMILESCOc1ccc(C(O)Cc2cc(F)ccc2F)nn1
InChIInChI=1S/C13H12F2N2O2/c1-19-13-5-4-11(16-17-13)12(18)7-8-6-9(14)2-3-10(8)15/h2-6,12,18H,7H2,1H3
InChIKeyOZTIHIGZLWQGNN-UHFFFAOYSA-N
MW266.25 g/mol
LogP2.04
Rot. Bonds4

About 2-(2,5-difluorophenyl)-1-(6-methoxypyridazin-3-yl)ethanol

2-(2,5-difluorophenyl)-1-(6-methoxypyridazin-3-yl)ethanol (PubChem CID 103373403) has the molecular formula C13H12F2N2O2 and a molecular weight of 266.25 g/mol. Its IUPAC name is 2-(2,5-difluorophenyl)-1-(6-methoxypyridazin-3-yl)ethanol.

Molecular Properties

Compound Name2-(2,5-difluorophenyl)-1-(6-methoxypyridazin-3-yl)ethanol
PubChem CID103373403
Molecular FormulaC13H12F2N2O2
Molecular Weight266.25 g/mol
Exact Mass266.09
IUPAC Name2-(2,5-difluorophenyl)-1-(6-methoxypyridazin-3-yl)ethanol
SMILESCOc1ccc(C(O)Cc2cc(F)ccc2F)nn1
InChIInChI=1S/C13H12F2N2O2/c1-19-13-5-4-11(16-17-13)12(18)7-8-6-9(14)2-3-10(8)15/h2-6,12,18H,7H2,1H3
InChIKeyOZTIHIGZLWQGNN-UHFFFAOYSA-N
XLogP2.04
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.25
LogP ≤ 52.04
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-(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
2-(6-Methoxypyridazin-3-YL)-4-(trifluoromethoxy)phenol
CID 137150764
3-(Difluoromethoxy)-6-(4-pentylphenyl)pyridazine
CID 6412190
3-[4-(Trifluoromethyl)phenyl]-6-methoxypyridazine
CID 16743327

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-difluorophenyl)-1-(6-methoxypyridazin-3-yl)ethanol?
The IUPAC name of 2-(2,5-difluorophenyl)-1-(6-methoxypyridazin-3-yl)ethanol (CID 103373403) is 2-(2,5-difluorophenyl)-1-(6-methoxypyridazin-3-yl)ethanol.
What is the SMILES notation for 2-(2,5-difluorophenyl)-1-(6-methoxypyridazin-3-yl)ethanol?
The canonical SMILES for 2-(2,5-difluorophenyl)-1-(6-methoxypyridazin-3-yl)ethanol is COc1ccc(C(O)Cc2cc(F)ccc2F)nn1.
What is the InChIKey of 2-(2,5-difluorophenyl)-1-(6-methoxypyridazin-3-yl)ethanol?
The InChIKey is OZTIHIGZLWQGNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12F2N2O2/c1-19-13-5-4-11(16-17-13)12(18)7-8-6-9(14)2-3-10(8)15/h2-6,12,18H,7H2,1H3.
What are the key properties of 2-(2,5-difluorophenyl)-1-(6-methoxypyridazin-3-yl)ethanol?
2-(2,5-difluorophenyl)-1-(6-methoxypyridazin-3-yl)ethanol has a molecular weight of 266.25 g/mol, XLogP of 2.04, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-difluorophenyl)-1-(6-methoxypyridazin-3-yl)ethanol is sourced from PubChem (CID 103373403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).