4-ethoxy-6-ethyl-7,8-dihydropyrazino[1,2-b]pyridazine-3,5-dione

C11H15N3O3 — CID 144807853

IUPAC4-ethoxy-6-ethyl-7,8-dihydropyrazino[1,2-b]pyridazine-3,5-dione
SMILESCCOc1c2n(ncc1=O)CCN(CC)C2=O
InChIInChI=1S/C11H15N3O3/c1-3-13-5-6-14-9(11(13)16)10(17-4-2)8(15)7-12-14/h7H,3-6H2,1-2H3
InChIKeyXGWFHQAFKKIKTL-UHFFFAOYSA-N
MW237.26 g/mol
LogP0.12
Rot. Bonds3

About 4-ethoxy-6-ethyl-7,8-dihydropyrazino[1,2-b]pyridazine-3,5-dione

4-ethoxy-6-ethyl-7,8-dihydropyrazino[1,2-b]pyridazine-3,5-dione (PubChem CID 144807853) has the molecular formula C11H15N3O3 and a molecular weight of 237.26 g/mol. Its IUPAC name is 4-ethoxy-6-ethyl-7,8-dihydropyrazino[1,2-b]pyridazine-3,5-dione.

Molecular Properties

Compound Name4-ethoxy-6-ethyl-7,8-dihydropyrazino[1,2-b]pyridazine-3,5-dione
PubChem CID144807853
Molecular FormulaC11H15N3O3
Molecular Weight237.26 g/mol
Exact Mass237.11
IUPAC Name4-ethoxy-6-ethyl-7,8-dihydropyrazino[1,2-b]pyridazine-3,5-dione
SMILESCCOc1c2n(ncc1=O)CCN(CC)C2=O
InChIInChI=1S/C11H15N3O3/c1-3-13-5-6-14-9(11(13)16)10(17-4-2)8(15)7-12-14/h7H,3-6H2,1-2H3
InChIKeyXGWFHQAFKKIKTL-UHFFFAOYSA-N
XLogP0.12
TPSA64.43 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 50.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-6-ethyl-7,8-dihydropyrazino[1,2-b]pyridazine-3,5-dione?
The IUPAC name of 4-ethoxy-6-ethyl-7,8-dihydropyrazino[1,2-b]pyridazine-3,5-dione (CID 144807853) is 4-ethoxy-6-ethyl-7,8-dihydropyrazino[1,2-b]pyridazine-3,5-dione.
What is the SMILES notation for 4-ethoxy-6-ethyl-7,8-dihydropyrazino[1,2-b]pyridazine-3,5-dione?
The canonical SMILES for 4-ethoxy-6-ethyl-7,8-dihydropyrazino[1,2-b]pyridazine-3,5-dione is CCOc1c2n(ncc1=O)CCN(CC)C2=O.
What is the InChIKey of 4-ethoxy-6-ethyl-7,8-dihydropyrazino[1,2-b]pyridazine-3,5-dione?
The InChIKey is XGWFHQAFKKIKTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O3/c1-3-13-5-6-14-9(11(13)16)10(17-4-2)8(15)7-12-14/h7H,3-6H2,1-2H3.
What are the key properties of 4-ethoxy-6-ethyl-7,8-dihydropyrazino[1,2-b]pyridazine-3,5-dione?
4-ethoxy-6-ethyl-7,8-dihydropyrazino[1,2-b]pyridazine-3,5-dione has a molecular weight of 237.26 g/mol, XLogP of 0.12, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-6-ethyl-7,8-dihydropyrazino[1,2-b]pyridazine-3,5-dione is sourced from PubChem (CID 144807853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).