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

C8H7N3O2S — CID 118009170

IUPACN-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide
SMILESCNC(=O)c1csc2nccc(=O)n12
InChIInChI=1S/C8H7N3O2S/c1-9-7(13)5-4-14-8-10-3-2-6(12)11(5)8/h2-4H,1H3,(H,9,13)
InChIKeyVPZOBQSVFCCQLY-UHFFFAOYSA-N
MW209.23 g/mol
LogP0.12
Rot. Bonds1

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

N-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide (PubChem CID 118009170) has the molecular formula C8H7N3O2S and a molecular weight of 209.23 g/mol. Its IUPAC name is N-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide
PubChem CID118009170
Molecular FormulaC8H7N3O2S
Molecular Weight209.23 g/mol
Exact Mass209.03
IUPAC NameN-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide
SMILESCNC(=O)c1csc2nccc(=O)n12
InChIInChI=1S/C8H7N3O2S/c1-9-7(13)5-4-14-8-10-3-2-6(12)11(5)8/h2-4H,1H3,(H,9,13)
InChIKeyVPZOBQSVFCCQLY-UHFFFAOYSA-N
XLogP0.12
TPSA63.47 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 ≤ 50.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide?
The IUPAC name of N-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide (CID 118009170) is N-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide is CNC(=O)c1csc2nccc(=O)n12.
What is the InChIKey of N-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide?
The InChIKey is VPZOBQSVFCCQLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N3O2S/c1-9-7(13)5-4-14-8-10-3-2-6(12)11(5)8/h2-4H,1H3,(H,9,13).
What are the key properties of N-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide?
N-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide has a molecular weight of 209.23 g/mol, XLogP of 0.12, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 118009170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).