7-ethyl-5-methylthieno[2,3-d]pyridazin-4-one

C9H10N2OS — CID 22054377

IUPAC7-ethyl-5-methylthieno[2,3-d]pyridazin-4-one
SMILESCCc1nn(C)c(=O)c2ccsc12
InChIInChI=1S/C9H10N2OS/c1-3-7-8-6(4-5-13-8)9(12)11(2)10-7/h4-5H,3H2,1-2H3
InChIKeyVQUQDPIWMNLPKK-UHFFFAOYSA-N
MW194.26 g/mol
LogP1.56
Rot. Bonds1

About 7-ethyl-5-methylthieno[2,3-d]pyridazin-4-one

7-ethyl-5-methylthieno[2,3-d]pyridazin-4-one (PubChem CID 22054377) has the molecular formula C9H10N2OS and a molecular weight of 194.26 g/mol. Its IUPAC name is 7-ethyl-5-methylthieno[2,3-d]pyridazin-4-one.

Molecular Properties

Compound Name7-ethyl-5-methylthieno[2,3-d]pyridazin-4-one
PubChem CID22054377
Molecular FormulaC9H10N2OS
Molecular Weight194.26 g/mol
Exact Mass194.05
IUPAC Name7-ethyl-5-methylthieno[2,3-d]pyridazin-4-one
SMILESCCc1nn(C)c(=O)c2ccsc12
InChIInChI=1S/C9H10N2OS/c1-3-7-8-6(4-5-13-8)9(12)11(2)10-7/h4-5H,3H2,1-2H3
InChIKeyVQUQDPIWMNLPKK-UHFFFAOYSA-N
XLogP1.56
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.26
LogP ≤ 51.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-ethyl-5-methylthieno[2,3-d]pyridazin-4-one?
The IUPAC name of 7-ethyl-5-methylthieno[2,3-d]pyridazin-4-one (CID 22054377) is 7-ethyl-5-methylthieno[2,3-d]pyridazin-4-one.
What is the SMILES notation for 7-ethyl-5-methylthieno[2,3-d]pyridazin-4-one?
The canonical SMILES for 7-ethyl-5-methylthieno[2,3-d]pyridazin-4-one is CCc1nn(C)c(=O)c2ccsc12.
What is the InChIKey of 7-ethyl-5-methylthieno[2,3-d]pyridazin-4-one?
The InChIKey is VQUQDPIWMNLPKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2OS/c1-3-7-8-6(4-5-13-8)9(12)11(2)10-7/h4-5H,3H2,1-2H3.
What are the key properties of 7-ethyl-5-methylthieno[2,3-d]pyridazin-4-one?
7-ethyl-5-methylthieno[2,3-d]pyridazin-4-one has a molecular weight of 194.26 g/mol, XLogP of 1.56, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyl-5-methylthieno[2,3-d]pyridazin-4-one is sourced from PubChem (CID 22054377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).