3-ethyl-6,7-dihydro-5H-[1,2]thiazolo[5,4-c]pyridin-4-one

C8H10N2OS — CID 82407683

IUPAC3-ethyl-6,7-dihydro-5H-[1,2]thiazolo[5,4-c]pyridin-4-one
SMILESCCc1nsc2c1C(=O)CNC2
InChIInChI=1S/C8H10N2OS/c1-2-5-8-6(11)3-9-4-7(8)12-10-5/h9H,2-4H2,1H3
InChIKeyWGBPLFTWAVYNLW-UHFFFAOYSA-N
MW182.25 g/mol
LogP0.99
Rot. Bonds1

About 3-ethyl-6,7-dihydro-5H-[1,2]thiazolo[5,4-c]pyridin-4-one

3-ethyl-6,7-dihydro-5H-[1,2]thiazolo[5,4-c]pyridin-4-one (PubChem CID 82407683) has the molecular formula C8H10N2OS and a molecular weight of 182.25 g/mol. Its IUPAC name is 3-ethyl-6,7-dihydro-5H-[1,2]thiazolo[5,4-c]pyridin-4-one.

Molecular Properties

Compound Name3-ethyl-6,7-dihydro-5H-[1,2]thiazolo[5,4-c]pyridin-4-one
PubChem CID82407683
Molecular FormulaC8H10N2OS
Molecular Weight182.25 g/mol
Exact Mass182.05
IUPAC Name3-ethyl-6,7-dihydro-5H-[1,2]thiazolo[5,4-c]pyridin-4-one
SMILESCCc1nsc2c1C(=O)CNC2
InChIInChI=1S/C8H10N2OS/c1-2-5-8-6(11)3-9-4-7(8)12-10-5/h9H,2-4H2,1H3
InChIKeyWGBPLFTWAVYNLW-UHFFFAOYSA-N
XLogP0.99
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.25
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-Ethyl-5-methyl-6,7-dihydro-[1,2]thiazolo[4,5-c]pyridin-4-one
CID 57678042
3,6-dimethyl-5H-[1,2]thiazolo[5,4-c]pyridine-4,7-dione
CID 82399630
3-Methyl-5,6-dihydro-[1,2]thiazolo[5,4-c]pyridine-4,7-dione
CID 96628022
3-methyl-6,7-dihydro-5H-[1,2]thiazolo[5,4-c]pyridin-4-one
CID 96632359

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-6,7-dihydro-5H-[1,2]thiazolo[5,4-c]pyridin-4-one?
The IUPAC name of 3-ethyl-6,7-dihydro-5H-[1,2]thiazolo[5,4-c]pyridin-4-one (CID 82407683) is 3-ethyl-6,7-dihydro-5H-[1,2]thiazolo[5,4-c]pyridin-4-one.
What is the SMILES notation for 3-ethyl-6,7-dihydro-5H-[1,2]thiazolo[5,4-c]pyridin-4-one?
The canonical SMILES for 3-ethyl-6,7-dihydro-5H-[1,2]thiazolo[5,4-c]pyridin-4-one is CCc1nsc2c1C(=O)CNC2.
What is the InChIKey of 3-ethyl-6,7-dihydro-5H-[1,2]thiazolo[5,4-c]pyridin-4-one?
The InChIKey is WGBPLFTWAVYNLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2OS/c1-2-5-8-6(11)3-9-4-7(8)12-10-5/h9H,2-4H2,1H3.
What are the key properties of 3-ethyl-6,7-dihydro-5H-[1,2]thiazolo[5,4-c]pyridin-4-one?
3-ethyl-6,7-dihydro-5H-[1,2]thiazolo[5,4-c]pyridin-4-one has a molecular weight of 182.25 g/mol, XLogP of 0.99, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-6,7-dihydro-5H-[1,2]thiazolo[5,4-c]pyridin-4-one is sourced from PubChem (CID 82407683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).