2-(6-chloropyridazin-3-yl)ethanol

C6H7ClN2O — CID 117104958

IUPAC2-(6-chloropyridazin-3-yl)ethanol
SMILESOCCc1ccc(Cl)nn1
InChIInChI=1S/C6H7ClN2O/c7-6-2-1-5(3-4-10)8-9-6/h1-2,10H,3-4H2
InChIKeyWAUGWWJQGTUNLO-UHFFFAOYSA-N
MW158.59 g/mol
LogP0.66
Rot. Bonds2

About 2-(6-chloropyridazin-3-yl)ethanol

2-(6-chloropyridazin-3-yl)ethanol (PubChem CID 117104958) has the molecular formula C6H7ClN2O and a molecular weight of 158.59 g/mol. Its IUPAC name is 2-(6-chloropyridazin-3-yl)ethanol.

Molecular Properties

Compound Name2-(6-chloropyridazin-3-yl)ethanol
PubChem CID117104958
Molecular FormulaC6H7ClN2O
Molecular Weight158.59 g/mol
Exact Mass158.02
IUPAC Name2-(6-chloropyridazin-3-yl)ethanol
SMILESOCCc1ccc(Cl)nn1
InChIInChI=1S/C6H7ClN2O/c7-6-2-1-5(3-4-10)8-9-6/h1-2,10H,3-4H2
InChIKeyWAUGWWJQGTUNLO-UHFFFAOYSA-N
XLogP0.66
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.59
LogP ≤ 50.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(6-chloropyridazin-3-yl)ethanol?
The IUPAC name of 2-(6-chloropyridazin-3-yl)ethanol (CID 117104958) is 2-(6-chloropyridazin-3-yl)ethanol.
What is the SMILES notation for 2-(6-chloropyridazin-3-yl)ethanol?
The canonical SMILES for 2-(6-chloropyridazin-3-yl)ethanol is OCCc1ccc(Cl)nn1.
What is the InChIKey of 2-(6-chloropyridazin-3-yl)ethanol?
The InChIKey is WAUGWWJQGTUNLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7ClN2O/c7-6-2-1-5(3-4-10)8-9-6/h1-2,10H,3-4H2.
What are the key properties of 2-(6-chloropyridazin-3-yl)ethanol?
2-(6-chloropyridazin-3-yl)ethanol has a molecular weight of 158.59 g/mol, XLogP of 0.66, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-chloropyridazin-3-yl)ethanol is sourced from PubChem (CID 117104958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).