6-(2,6-dimethylmorpholine-4-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one

C13H15N3O3S — CID 4293963

IUPAC6-(2,6-dimethylmorpholine-4-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one
SMILESCC1CN(C(=O)c2cnc3sccn3c2=O)CC(C)O1
InChIInChI=1S/C13H15N3O3S/c1-8-6-15(7-9(2)19-8)11(17)10-5-14-13-16(12(10)18)3-4-20-13/h3-5,8-9H,6-7H2,1-2H3
InChIKeyYUQQZXCVKSDSNG-UHFFFAOYSA-N
MW293.35 g/mol
LogP1.01
Rot. Bonds1

About 6-(2,6-dimethylmorpholine-4-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one

6-(2,6-dimethylmorpholine-4-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one (PubChem CID 4293963) has the molecular formula C13H15N3O3S and a molecular weight of 293.35 g/mol. Its IUPAC name is 6-(2,6-dimethylmorpholine-4-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one.

Molecular Properties

Compound Name6-(2,6-dimethylmorpholine-4-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one
PubChem CID4293963
Molecular FormulaC13H15N3O3S
Molecular Weight293.35 g/mol
Exact Mass293.08
IUPAC Name6-(2,6-dimethylmorpholine-4-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one
SMILESCC1CN(C(=O)c2cnc3sccn3c2=O)CC(C)O1
InChIInChI=1S/C13H15N3O3S/c1-8-6-15(7-9(2)19-8)11(17)10-5-14-13-16(12(10)18)3-4-20-13/h3-5,8-9H,6-7H2,1-2H3
InChIKeyYUQQZXCVKSDSNG-UHFFFAOYSA-N
XLogP1.01
TPSA63.91 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.35
LogP ≤ 51.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(2,6-dimethylmorpholine-4-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one?
The IUPAC name of 6-(2,6-dimethylmorpholine-4-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one (CID 4293963) is 6-(2,6-dimethylmorpholine-4-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one.
What is the SMILES notation for 6-(2,6-dimethylmorpholine-4-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one?
The canonical SMILES for 6-(2,6-dimethylmorpholine-4-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one is CC1CN(C(=O)c2cnc3sccn3c2=O)CC(C)O1.
What is the InChIKey of 6-(2,6-dimethylmorpholine-4-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one?
The InChIKey is YUQQZXCVKSDSNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O3S/c1-8-6-15(7-9(2)19-8)11(17)10-5-14-13-16(12(10)18)3-4-20-13/h3-5,8-9H,6-7H2,1-2H3.
What are the key properties of 6-(2,6-dimethylmorpholine-4-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one?
6-(2,6-dimethylmorpholine-4-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one has a molecular weight of 293.35 g/mol, XLogP of 1.01, 1 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,6-dimethylmorpholine-4-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one is sourced from PubChem (CID 4293963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).