5-oxo-N-pyrimidin-2-yl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide

C11H9N5O2S — CID 13379284

IUPAC5-oxo-N-pyrimidin-2-yl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
SMILESO=C(Nc1ncccn1)c1cnc2n(c1=O)CCS2
InChIInChI=1S/C11H9N5O2S/c17-8(15-10-12-2-1-3-13-10)7-6-14-11-16(9(7)18)4-5-19-11/h1-3,6H,4-5H2,(H,12,13,15,17)
InChIKeyBUOODJPPQOGNHJ-UHFFFAOYSA-N
MW275.29 g/mol
LogP0.39
Rot. Bonds2

About 5-oxo-N-pyrimidin-2-yl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide

5-oxo-N-pyrimidin-2-yl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide (PubChem CID 13379284) has the molecular formula C11H9N5O2S and a molecular weight of 275.29 g/mol. Its IUPAC name is 5-oxo-N-pyrimidin-2-yl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide.

Molecular Properties

Compound Name5-oxo-N-pyrimidin-2-yl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
PubChem CID13379284
Molecular FormulaC11H9N5O2S
Molecular Weight275.29 g/mol
Exact Mass275.05
IUPAC Name5-oxo-N-pyrimidin-2-yl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
SMILESO=C(Nc1ncccn1)c1cnc2n(c1=O)CCS2
InChIInChI=1S/C11H9N5O2S/c17-8(15-10-12-2-1-3-13-10)7-6-14-11-16(9(7)18)4-5-19-11/h1-3,6H,4-5H2,(H,12,13,15,17)
InChIKeyBUOODJPPQOGNHJ-UHFFFAOYSA-N
XLogP0.39
TPSA89.77 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.29
LogP ≤ 50.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 5-oxo-N-pyrimidin-2-yl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide?
The IUPAC name of 5-oxo-N-pyrimidin-2-yl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide (CID 13379284) is 5-oxo-N-pyrimidin-2-yl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide.
What is the SMILES notation for 5-oxo-N-pyrimidin-2-yl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide?
The canonical SMILES for 5-oxo-N-pyrimidin-2-yl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide is O=C(Nc1ncccn1)c1cnc2n(c1=O)CCS2.
What is the InChIKey of 5-oxo-N-pyrimidin-2-yl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide?
The InChIKey is BUOODJPPQOGNHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N5O2S/c17-8(15-10-12-2-1-3-13-10)7-6-14-11-16(9(7)18)4-5-19-11/h1-3,6H,4-5H2,(H,12,13,15,17).
What are the key properties of 5-oxo-N-pyrimidin-2-yl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide?
5-oxo-N-pyrimidin-2-yl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide has a molecular weight of 275.29 g/mol, XLogP of 0.39, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-N-pyrimidin-2-yl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide is sourced from PubChem (CID 13379284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).