(5-aminothieno[2,3-c]pyridazin-6-yl)-morpholin-4-ylmethanone

C11H12N4O2S — CID 80518433

IUPAC(5-aminothieno[2,3-c]pyridazin-6-yl)-morpholin-4-ylmethanone
SMILESNc1c(C(=O)N2CCOCC2)sc2nnccc12
InChIInChI=1S/C11H12N4O2S/c12-8-7-1-2-13-14-10(7)18-9(8)11(16)15-3-5-17-6-4-15/h1-2H,3-6,12H2
InChIKeyCQSHHSWHPPEUHL-UHFFFAOYSA-N
MW264.31 g/mol
LogP0.75
Rot. Bonds1

About (5-aminothieno[2,3-c]pyridazin-6-yl)-morpholin-4-ylmethanone

(5-aminothieno[2,3-c]pyridazin-6-yl)-morpholin-4-ylmethanone (PubChem CID 80518433) has the molecular formula C11H12N4O2S and a molecular weight of 264.31 g/mol. Its IUPAC name is (5-aminothieno[2,3-c]pyridazin-6-yl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(5-aminothieno[2,3-c]pyridazin-6-yl)-morpholin-4-ylmethanone
PubChem CID80518433
Molecular FormulaC11H12N4O2S
Molecular Weight264.31 g/mol
Exact Mass264.07
IUPAC Name(5-aminothieno[2,3-c]pyridazin-6-yl)-morpholin-4-ylmethanone
SMILESNc1c(C(=O)N2CCOCC2)sc2nnccc12
InChIInChI=1S/C11H12N4O2S/c12-8-7-1-2-13-14-10(7)18-9(8)11(16)15-3-5-17-6-4-15/h1-2H,3-6,12H2
InChIKeyCQSHHSWHPPEUHL-UHFFFAOYSA-N
XLogP0.75
TPSA81.34 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.31
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (5-aminothieno[2,3-c]pyridazin-6-yl)-morpholin-4-ylmethanone?
The IUPAC name of (5-aminothieno[2,3-c]pyridazin-6-yl)-morpholin-4-ylmethanone (CID 80518433) is (5-aminothieno[2,3-c]pyridazin-6-yl)-morpholin-4-ylmethanone.
What is the SMILES notation for (5-aminothieno[2,3-c]pyridazin-6-yl)-morpholin-4-ylmethanone?
The canonical SMILES for (5-aminothieno[2,3-c]pyridazin-6-yl)-morpholin-4-ylmethanone is Nc1c(C(=O)N2CCOCC2)sc2nnccc12.
What is the InChIKey of (5-aminothieno[2,3-c]pyridazin-6-yl)-morpholin-4-ylmethanone?
The InChIKey is CQSHHSWHPPEUHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O2S/c12-8-7-1-2-13-14-10(7)18-9(8)11(16)15-3-5-17-6-4-15/h1-2H,3-6,12H2.
What are the key properties of (5-aminothieno[2,3-c]pyridazin-6-yl)-morpholin-4-ylmethanone?
(5-aminothieno[2,3-c]pyridazin-6-yl)-morpholin-4-ylmethanone has a molecular weight of 264.31 g/mol, XLogP of 0.75, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (5-aminothieno[2,3-c]pyridazin-6-yl)-morpholin-4-ylmethanone is sourced from PubChem (CID 80518433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).