7-ethyl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one

C8H10N2OS — CID 86221255

IUPAC7-ethyl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one
SMILESCCc1cc(=O)n2c(n1)SCC2
InChIInChI=1S/C8H10N2OS/c1-2-6-5-7(11)10-3-4-12-8(10)9-6/h5H,2-4H2,1H3
InChIKeyPYOQZORHDPXPKJ-UHFFFAOYSA-N
MW182.25 g/mol
LogP0.91
Rot. Bonds1

About 7-ethyl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one

7-ethyl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one (PubChem CID 86221255) has the molecular formula C8H10N2OS and a molecular weight of 182.25 g/mol. Its IUPAC name is 7-ethyl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one.

Molecular Properties

Compound Name7-ethyl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one
PubChem CID86221255
Molecular FormulaC8H10N2OS
Molecular Weight182.25 g/mol
Exact Mass182.05
IUPAC Name7-ethyl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one
SMILESCCc1cc(=O)n2c(n1)SCC2
InChIInChI=1S/C8H10N2OS/c1-2-6-5-7(11)10-3-4-12-8(10)9-6/h5H,2-4H2,1H3
InChIKeyPYOQZORHDPXPKJ-UHFFFAOYSA-N
XLogP0.91
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.25
LogP ≤ 50.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-ethyl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one?
The IUPAC name of 7-ethyl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one (CID 86221255) is 7-ethyl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one.
What is the SMILES notation for 7-ethyl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one?
The canonical SMILES for 7-ethyl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one is CCc1cc(=O)n2c(n1)SCC2.
What is the InChIKey of 7-ethyl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one?
The InChIKey is PYOQZORHDPXPKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2OS/c1-2-6-5-7(11)10-3-4-12-8(10)9-6/h5H,2-4H2,1H3.
What are the key properties of 7-ethyl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one?
7-ethyl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one has a molecular weight of 182.25 g/mol, XLogP of 0.91, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one is sourced from PubChem (CID 86221255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).