1-pyridazin-3-ylethanol

C6H8N2O — CID 15197511

IUPAC1-pyridazin-3-ylethanol
SMILESCC(O)c1cccnn1
InChIInChI=1S/C6H8N2O/c1-5(9)6-3-2-4-7-8-6/h2-5,9H,1H3
InChIKeyREKAZYZDOBKGMH-UHFFFAOYSA-N
MW124.14 g/mol
LogP0.53
Rot. Bonds1

About 1-pyridazin-3-ylethanol

1-pyridazin-3-ylethanol (PubChem CID 15197511) has the molecular formula C6H8N2O and a molecular weight of 124.14 g/mol. Its IUPAC name is 1-pyridazin-3-ylethanol.

Molecular Properties

Compound Name1-pyridazin-3-ylethanol
PubChem CID15197511
Molecular FormulaC6H8N2O
Molecular Weight124.14 g/mol
Exact Mass124.06
IUPAC Name1-pyridazin-3-ylethanol
SMILESCC(O)c1cccnn1
InChIInChI=1S/C6H8N2O/c1-5(9)6-3-2-4-7-8-6/h2-5,9H,1H3
InChIKeyREKAZYZDOBKGMH-UHFFFAOYSA-N
XLogP0.53
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.14
LogP ≤ 50.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-pyridazin-3-ylethanol?
The IUPAC name of 1-pyridazin-3-ylethanol (CID 15197511) is 1-pyridazin-3-ylethanol.
What is the SMILES notation for 1-pyridazin-3-ylethanol?
The canonical SMILES for 1-pyridazin-3-ylethanol is CC(O)c1cccnn1.
What is the InChIKey of 1-pyridazin-3-ylethanol?
The InChIKey is REKAZYZDOBKGMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O/c1-5(9)6-3-2-4-7-8-6/h2-5,9H,1H3.
What are the key properties of 1-pyridazin-3-ylethanol?
1-pyridazin-3-ylethanol has a molecular weight of 124.14 g/mol, XLogP of 0.53, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyridazin-3-ylethanol is sourced from PubChem (CID 15197511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).