5,6-dimethoxy-2-methylpyridazin-3-one

C7H10N2O3 — CID 10607232

IUPAC5,6-dimethoxy-2-methylpyridazin-3-one
SMILESCOc1cc(=O)n(C)nc1OC
InChIInChI=1S/C7H10N2O3/c1-9-6(10)4-5(11-2)7(8-9)12-3/h4H,1-3H3
InChIKeyXUODAGPRKYYJBN-UHFFFAOYSA-N
MW170.17 g/mol
LogP-0.20
Rot. Bonds2

About 5,6-dimethoxy-2-methylpyridazin-3-one

5,6-dimethoxy-2-methylpyridazin-3-one (PubChem CID 10607232) has the molecular formula C7H10N2O3 and a molecular weight of 170.17 g/mol. Its IUPAC name is 5,6-dimethoxy-2-methylpyridazin-3-one.

Molecular Properties

Compound Name5,6-dimethoxy-2-methylpyridazin-3-one
PubChem CID10607232
Molecular FormulaC7H10N2O3
Molecular Weight170.17 g/mol
Exact Mass170.07
IUPAC Name5,6-dimethoxy-2-methylpyridazin-3-one
SMILESCOc1cc(=O)n(C)nc1OC
InChIInChI=1S/C7H10N2O3/c1-9-6(10)4-5(11-2)7(8-9)12-3/h4H,1-3H3
InChIKeyXUODAGPRKYYJBN-UHFFFAOYSA-N
XLogP-0.20
TPSA53.35 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.17
LogP ≤ 5-0.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5,6-dimethoxy-2-methylpyridazin-3-one?
The IUPAC name of 5,6-dimethoxy-2-methylpyridazin-3-one (CID 10607232) is 5,6-dimethoxy-2-methylpyridazin-3-one.
What is the SMILES notation for 5,6-dimethoxy-2-methylpyridazin-3-one?
The canonical SMILES for 5,6-dimethoxy-2-methylpyridazin-3-one is COc1cc(=O)n(C)nc1OC.
What is the InChIKey of 5,6-dimethoxy-2-methylpyridazin-3-one?
The InChIKey is XUODAGPRKYYJBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O3/c1-9-6(10)4-5(11-2)7(8-9)12-3/h4H,1-3H3.
What are the key properties of 5,6-dimethoxy-2-methylpyridazin-3-one?
5,6-dimethoxy-2-methylpyridazin-3-one has a molecular weight of 170.17 g/mol, XLogP of -0.20, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dimethoxy-2-methylpyridazin-3-one is sourced from PubChem (CID 10607232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).