6-methyl-4H-[1,3]thiazolo[5,4-b]pyridin-7-one

C7H6N2OS — CID 18342943

IUPAC6-methyl-4H-[1,3]thiazolo[5,4-b]pyridin-7-one
SMILESCc1c[nH]c2scnc2c1=O
InChIInChI=1S/C7H6N2OS/c1-4-2-8-7-5(6(4)10)9-3-11-7/h2-3H,1H3,(H,8,10)
InChIKeyXDIGMOWOTBBSGG-UHFFFAOYSA-N
MW166.21 g/mol
LogP1.29
Rot. Bonds

About 6-methyl-4H-[1,3]thiazolo[5,4-b]pyridin-7-one

6-methyl-4H-[1,3]thiazolo[5,4-b]pyridin-7-one (PubChem CID 18342943) has the molecular formula C7H6N2OS and a molecular weight of 166.21 g/mol. Its IUPAC name is 6-methyl-4H-[1,3]thiazolo[5,4-b]pyridin-7-one.

Molecular Properties

Compound Name6-methyl-4H-[1,3]thiazolo[5,4-b]pyridin-7-one
PubChem CID18342943
Molecular FormulaC7H6N2OS
Molecular Weight166.21 g/mol
Exact Mass166.02
IUPAC Name6-methyl-4H-[1,3]thiazolo[5,4-b]pyridin-7-one
SMILESCc1c[nH]c2scnc2c1=O
InChIInChI=1S/C7H6N2OS/c1-4-2-8-7-5(6(4)10)9-3-11-7/h2-3H,1H3,(H,8,10)
InChIKeyXDIGMOWOTBBSGG-UHFFFAOYSA-N
XLogP1.29
TPSA45.75 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.21
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-methyl-4H-[1,3]thiazolo[5,4-b]pyridin-7-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-methyl-4H-[1,3]thiazolo[5,4-b]pyridin-7-one?
The IUPAC name of 6-methyl-4H-[1,3]thiazolo[5,4-b]pyridin-7-one (CID 18342943) is 6-methyl-4H-[1,3]thiazolo[5,4-b]pyridin-7-one.
What is the SMILES notation for 6-methyl-4H-[1,3]thiazolo[5,4-b]pyridin-7-one?
The canonical SMILES for 6-methyl-4H-[1,3]thiazolo[5,4-b]pyridin-7-one is Cc1c[nH]c2scnc2c1=O.
What is the InChIKey of 6-methyl-4H-[1,3]thiazolo[5,4-b]pyridin-7-one?
The InChIKey is XDIGMOWOTBBSGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N2OS/c1-4-2-8-7-5(6(4)10)9-3-11-7/h2-3H,1H3,(H,8,10).
What are the key properties of 6-methyl-4H-[1,3]thiazolo[5,4-b]pyridin-7-one?
6-methyl-4H-[1,3]thiazolo[5,4-b]pyridin-7-one has a molecular weight of 166.21 g/mol, XLogP of 1.29, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4H-[1,3]thiazolo[5,4-b]pyridin-7-one is sourced from PubChem (CID 18342943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).