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

C7H5N3O2S — CID 140733512

IUPAC5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide
SMILESNC(=O)c1csc2nccc(=O)n12
InChIInChI=1S/C7H5N3O2S/c8-6(12)4-3-13-7-9-2-1-5(11)10(4)7/h1-3H,(H2,8,12)
InChIKeyLCJGVBLXJOYVCN-UHFFFAOYSA-N
MW195.20 g/mol
LogP-0.15
Rot. Bonds1

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

5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide (PubChem CID 140733512) has the molecular formula C7H5N3O2S and a molecular weight of 195.20 g/mol. Its IUPAC name is 5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide
PubChem CID140733512
Molecular FormulaC7H5N3O2S
Molecular Weight195.20 g/mol
Exact Mass195.01
IUPAC Name5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide
SMILESNC(=O)c1csc2nccc(=O)n12
InChIInChI=1S/C7H5N3O2S/c8-6(12)4-3-13-7-9-2-1-5(11)10(4)7/h1-3H,(H2,8,12)
InChIKeyLCJGVBLXJOYVCN-UHFFFAOYSA-N
XLogP-0.15
TPSA77.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.20
LogP ≤ 5-0.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide?
The IUPAC name of 5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide (CID 140733512) is 5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide?
The canonical SMILES for 5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide is NC(=O)c1csc2nccc(=O)n12.
What is the InChIKey of 5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide?
The InChIKey is LCJGVBLXJOYVCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5N3O2S/c8-6(12)4-3-13-7-9-2-1-5(11)10(4)7/h1-3H,(H2,8,12).
What are the key properties of 5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide?
5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide has a molecular weight of 195.20 g/mol, XLogP of -0.15, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 140733512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).