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

C7H8N2OS — CID 130250914

IUPAC2-methyl-5,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-6-one
SMILESCc1nc2c(s1)CC(=O)NC2
InChIInChI=1S/C7H8N2OS/c1-4-9-5-3-8-7(10)2-6(5)11-4/h2-3H2,1H3,(H,8,10)
InChIKeyUVFFPOBIMLHRCA-UHFFFAOYSA-N
MW168.22 g/mol
LogP0.62
Rot. Bonds

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

2-methyl-5,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-6-one (PubChem CID 130250914) has the molecular formula C7H8N2OS and a molecular weight of 168.22 g/mol. Its IUPAC name is 2-methyl-5,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-6-one.

Molecular Properties

Compound Name2-methyl-5,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-6-one
PubChem CID130250914
Molecular FormulaC7H8N2OS
Molecular Weight168.22 g/mol
Exact Mass168.04
IUPAC Name2-methyl-5,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-6-one
SMILESCc1nc2c(s1)CC(=O)NC2
InChIInChI=1S/C7H8N2OS/c1-4-9-5-3-8-7(10)2-6(5)11-4/h2-3H2,1H3,(H,8,10)
InChIKeyUVFFPOBIMLHRCA-UHFFFAOYSA-N
XLogP0.62
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.22
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-5,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-6-one?
The IUPAC name of 2-methyl-5,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-6-one (CID 130250914) is 2-methyl-5,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-6-one.
What is the SMILES notation for 2-methyl-5,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-6-one?
The canonical SMILES for 2-methyl-5,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-6-one is Cc1nc2c(s1)CC(=O)NC2.
What is the InChIKey of 2-methyl-5,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-6-one?
The InChIKey is UVFFPOBIMLHRCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2OS/c1-4-9-5-3-8-7(10)2-6(5)11-4/h2-3H2,1H3,(H,8,10).
What are the key properties of 2-methyl-5,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-6-one?
2-methyl-5,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-6-one has a molecular weight of 168.22 g/mol, XLogP of 0.62, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-6-one is sourced from PubChem (CID 130250914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).