6-ethyl-4H-pyridazin-5-one

C6H8N2O — CID 55269929

IUPAC6-ethyl-4H-pyridazin-5-one
SMILESCCC1=NN=CCC1=O
InChIInChI=1S/C6H8N2O/c1-2-5-6(9)3-4-7-8-5/h4H,2-3H2,1H3
InChIKeyZUOBKUUUXRWBAF-UHFFFAOYSA-N
MW124.14 g/mol
LogP0.80
Rot. Bonds1

About 6-ethyl-4H-pyridazin-5-one

6-ethyl-4H-pyridazin-5-one (PubChem CID 55269929) has the molecular formula C6H8N2O and a molecular weight of 124.14 g/mol. Its IUPAC name is 6-ethyl-4H-pyridazin-5-one.

Molecular Properties

Compound Name6-ethyl-4H-pyridazin-5-one
PubChem CID55269929
Molecular FormulaC6H8N2O
Molecular Weight124.14 g/mol
Exact Mass124.06
IUPAC Name6-ethyl-4H-pyridazin-5-one
SMILESCCC1=NN=CCC1=O
InChIInChI=1S/C6H8N2O/c1-2-5-6(9)3-4-7-8-5/h4H,2-3H2,1H3
InChIKeyZUOBKUUUXRWBAF-UHFFFAOYSA-N
XLogP0.80
TPSA41.79 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.14
LogP ≤ 50.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-4H-pyridazin-5-one?
The IUPAC name of 6-ethyl-4H-pyridazin-5-one (CID 55269929) is 6-ethyl-4H-pyridazin-5-one.
What is the SMILES notation for 6-ethyl-4H-pyridazin-5-one?
The canonical SMILES for 6-ethyl-4H-pyridazin-5-one is CCC1=NN=CCC1=O.
What is the InChIKey of 6-ethyl-4H-pyridazin-5-one?
The InChIKey is ZUOBKUUUXRWBAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O/c1-2-5-6(9)3-4-7-8-5/h4H,2-3H2,1H3.
What are the key properties of 6-ethyl-4H-pyridazin-5-one?
6-ethyl-4H-pyridazin-5-one has a molecular weight of 124.14 g/mol, XLogP of 0.80, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-4H-pyridazin-5-one is sourced from PubChem (CID 55269929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).