5-oxo-N-(1H-pyrazol-4-yl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide

C10H9N5O2S — CID 43430746

IUPAC5-oxo-N-(1H-pyrazol-4-yl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
SMILESO=C(Nc1cn[nH]c1)c1cnc2n(c1=O)CCS2
InChIInChI=1S/C10H9N5O2S/c16-8(14-6-3-12-13-4-6)7-5-11-10-15(9(7)17)1-2-18-10/h3-5H,1-2H2,(H,12,13)(H,14,16)
InChIKeyGNXSZBKMWRVRQE-UHFFFAOYSA-N
MW263.28 g/mol
LogP0.32
Rot. Bonds2

About 5-oxo-N-(1H-pyrazol-4-yl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide

5-oxo-N-(1H-pyrazol-4-yl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide (PubChem CID 43430746) has the molecular formula C10H9N5O2S and a molecular weight of 263.28 g/mol. Its IUPAC name is 5-oxo-N-(1H-pyrazol-4-yl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide.

Molecular Properties

Compound Name5-oxo-N-(1H-pyrazol-4-yl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
PubChem CID43430746
Molecular FormulaC10H9N5O2S
Molecular Weight263.28 g/mol
Exact Mass263.05
IUPAC Name5-oxo-N-(1H-pyrazol-4-yl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
SMILESO=C(Nc1cn[nH]c1)c1cnc2n(c1=O)CCS2
InChIInChI=1S/C10H9N5O2S/c16-8(14-6-3-12-13-4-6)7-5-11-10-15(9(7)17)1-2-18-10/h3-5H,1-2H2,(H,12,13)(H,14,16)
InChIKeyGNXSZBKMWRVRQE-UHFFFAOYSA-N
XLogP0.32
TPSA92.67 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.28
LogP ≤ 50.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-oxo-N-(1H-pyrazol-4-yl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide?
The IUPAC name of 5-oxo-N-(1H-pyrazol-4-yl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide (CID 43430746) is 5-oxo-N-(1H-pyrazol-4-yl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide.
What is the SMILES notation for 5-oxo-N-(1H-pyrazol-4-yl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide?
The canonical SMILES for 5-oxo-N-(1H-pyrazol-4-yl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide is O=C(Nc1cn[nH]c1)c1cnc2n(c1=O)CCS2.
What is the InChIKey of 5-oxo-N-(1H-pyrazol-4-yl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide?
The InChIKey is GNXSZBKMWRVRQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N5O2S/c16-8(14-6-3-12-13-4-6)7-5-11-10-15(9(7)17)1-2-18-10/h3-5H,1-2H2,(H,12,13)(H,14,16).
What are the key properties of 5-oxo-N-(1H-pyrazol-4-yl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide?
5-oxo-N-(1H-pyrazol-4-yl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide has a molecular weight of 263.28 g/mol, XLogP of 0.32, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-N-(1H-pyrazol-4-yl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide is sourced from PubChem (CID 43430746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).