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

C13H17N3O3S — CID 47158165

IUPAC6-(2-ethylmorpholine-4-carbonyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one
SMILESCCC1CN(C(=O)c2cnc3n(c2=O)CCS3)CCO1
InChIInChI=1S/C13H17N3O3S/c1-2-9-8-15(3-5-19-9)11(17)10-7-14-13-16(12(10)18)4-6-20-13/h7,9H,2-6,8H2,1H3
InChIKeyIYWBTSLXFDZNQC-UHFFFAOYSA-N
MW295.36 g/mol
LogP0.60
Rot. Bonds2

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

6-(2-ethylmorpholine-4-carbonyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one (PubChem CID 47158165) has the molecular formula C13H17N3O3S and a molecular weight of 295.36 g/mol. Its IUPAC name is 6-(2-ethylmorpholine-4-carbonyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one.

Molecular Properties

Compound Name6-(2-ethylmorpholine-4-carbonyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one
PubChem CID47158165
Molecular FormulaC13H17N3O3S
Molecular Weight295.36 g/mol
Exact Mass295.10
IUPAC Name6-(2-ethylmorpholine-4-carbonyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one
SMILESCCC1CN(C(=O)c2cnc3n(c2=O)CCS3)CCO1
InChIInChI=1S/C13H17N3O3S/c1-2-9-8-15(3-5-19-9)11(17)10-7-14-13-16(12(10)18)4-6-20-13/h7,9H,2-6,8H2,1H3
InChIKeyIYWBTSLXFDZNQC-UHFFFAOYSA-N
XLogP0.60
TPSA64.43 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.36
LogP ≤ 50.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

Morpholine, 4-((2,3-dihydro-5-oxo-5H-thiazolo(3,2-a)pyrimidin-6-yl)carbonyl)-
CID 13379281
5H-Thiazolo[3,2-a]pyrimidin-5-one, 6-(4-morpholinylcarbonyl)-
CID 4293962
N-(2-morpholin-4-ylethyl)-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
CID 4160431
5-oxo-N-(3-propan-2-yloxypropyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
CID 5227429
3-Methyl-6-(morpholine-4-carbonyl)-5H-[1,3]thiazolo[3,2-A]pyrimidin-5-one
CID 4405956
3-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CID 16867727
6,7-dimethyl-3-(2-morpholino-2-oxoethyl)-2H-thiazolo[3,2-a]pyrimidin-5(3H)-one
CID 16868976
2-Morpholin-4-yl-6-(pyrrolidine-1-carbonyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
CID 20942743
6-(Morpholine-4-carbonyl)-2-(pyrrolidin-1-YL)-5H-[1,3,4]thiadiazolo[3,2-A]pyrimidin-5-one
CID 20942831
6-Methyl-3-(2-morpholin-4-yl-2-oxoethyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CID 44044832
2,3-Dimethyl-6-(morpholine-4-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CID 99821358
6-(2,6-Dimethylmorpholine-4-carbonyl)-3-ethyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CID 126469163

Frequently Asked Questions

What is the IUPAC name of 6-(2-ethylmorpholine-4-carbonyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one?
The IUPAC name of 6-(2-ethylmorpholine-4-carbonyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one (CID 47158165) is 6-(2-ethylmorpholine-4-carbonyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one.
What is the SMILES notation for 6-(2-ethylmorpholine-4-carbonyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one?
The canonical SMILES for 6-(2-ethylmorpholine-4-carbonyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one is CCC1CN(C(=O)c2cnc3n(c2=O)CCS3)CCO1.
What is the InChIKey of 6-(2-ethylmorpholine-4-carbonyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one?
The InChIKey is IYWBTSLXFDZNQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O3S/c1-2-9-8-15(3-5-19-9)11(17)10-7-14-13-16(12(10)18)4-6-20-13/h7,9H,2-6,8H2,1H3.
What are the key properties of 6-(2-ethylmorpholine-4-carbonyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one?
6-(2-ethylmorpholine-4-carbonyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one has a molecular weight of 295.36 g/mol, XLogP of 0.60, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-ethylmorpholine-4-carbonyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one is sourced from PubChem (CID 47158165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).