2-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide

C8H7N3O2S — CID 118009168

IUPAC2-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide
SMILESCc1sc2nccc(=O)n2c1C(N)=O
InChIInChI=1S/C8H7N3O2S/c1-4-6(7(9)13)11-5(12)2-3-10-8(11)14-4/h2-3H,1H3,(H2,9,13)
InChIKeyWPHXOHVLYGKTRH-UHFFFAOYSA-N
MW209.23 g/mol
LogP0.16
Rot. Bonds1

About 2-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide

2-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide (PubChem CID 118009168) has the molecular formula C8H7N3O2S and a molecular weight of 209.23 g/mol. Its IUPAC name is 2-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name2-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide
PubChem CID118009168
Molecular FormulaC8H7N3O2S
Molecular Weight209.23 g/mol
Exact Mass209.03
IUPAC Name2-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide
SMILESCc1sc2nccc(=O)n2c1C(N)=O
InChIInChI=1S/C8H7N3O2S/c1-4-6(7(9)13)11-5(12)2-3-10-8(11)14-4/h2-3H,1H3,(H2,9,13)
InChIKeyWPHXOHVLYGKTRH-UHFFFAOYSA-N
XLogP0.16
TPSA77.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.23
LogP ≤ 50.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide?
The IUPAC name of 2-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide (CID 118009168) is 2-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 2-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide?
The canonical SMILES for 2-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide is Cc1sc2nccc(=O)n2c1C(N)=O.
What is the InChIKey of 2-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide?
The InChIKey is WPHXOHVLYGKTRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N3O2S/c1-4-6(7(9)13)11-5(12)2-3-10-8(11)14-4/h2-3H,1H3,(H2,9,13).
What are the key properties of 2-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide?
2-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide has a molecular weight of 209.23 g/mol, XLogP of 0.16, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 118009168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).