2-ethyl-5-methoxypyridazin-3-one

C7H10N2O2 — CID 66865616

IUPAC2-ethyl-5-methoxypyridazin-3-one
SMILESCCn1ncc(OC)cc1=O
InChIInChI=1S/C7H10N2O2/c1-3-9-7(10)4-6(11-2)5-8-9/h4-5H,3H2,1-2H3
InChIKeyXGZQXWURILUCRL-UHFFFAOYSA-N
MW154.17 g/mol
LogP0.27
Rot. Bonds2

About 2-ethyl-5-methoxypyridazin-3-one

2-ethyl-5-methoxypyridazin-3-one (PubChem CID 66865616) has the molecular formula C7H10N2O2 and a molecular weight of 154.17 g/mol. Its IUPAC name is 2-ethyl-5-methoxypyridazin-3-one.

Molecular Properties

Compound Name2-ethyl-5-methoxypyridazin-3-one
PubChem CID66865616
Molecular FormulaC7H10N2O2
Molecular Weight154.17 g/mol
Exact Mass154.07
IUPAC Name2-ethyl-5-methoxypyridazin-3-one
SMILESCCn1ncc(OC)cc1=O
InChIInChI=1S/C7H10N2O2/c1-3-9-7(10)4-6(11-2)5-8-9/h4-5H,3H2,1-2H3
InChIKeyXGZQXWURILUCRL-UHFFFAOYSA-N
XLogP0.27
TPSA44.12 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 50.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-5-methoxypyridazin-3-one?
The IUPAC name of 2-ethyl-5-methoxypyridazin-3-one (CID 66865616) is 2-ethyl-5-methoxypyridazin-3-one.
What is the SMILES notation for 2-ethyl-5-methoxypyridazin-3-one?
The canonical SMILES for 2-ethyl-5-methoxypyridazin-3-one is CCn1ncc(OC)cc1=O.
What is the InChIKey of 2-ethyl-5-methoxypyridazin-3-one?
The InChIKey is XGZQXWURILUCRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O2/c1-3-9-7(10)4-6(11-2)5-8-9/h4-5H,3H2,1-2H3.
What are the key properties of 2-ethyl-5-methoxypyridazin-3-one?
2-ethyl-5-methoxypyridazin-3-one has a molecular weight of 154.17 g/mol, XLogP of 0.27, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-5-methoxypyridazin-3-one is sourced from PubChem (CID 66865616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).