5-[5-(trifluoromethyl)-1,3-thiazol-2-yl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one

C10H7F3N4OS — CID 175970011

IUPAC5-[5-(trifluoromethyl)-1,3-thiazol-2-yl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
SMILESO=C1c2ccnn2CCN1c1ncc(C(F)(F)F)s1
InChIInChI=1S/C10H7F3N4OS/c11-10(12,13)7-5-14-9(19-7)16-3-4-17-6(8(16)18)1-2-15-17/h1-2,5H,3-4H2
InChIKeyUEVIXWLZUGEAGF-UHFFFAOYSA-N
MW288.25 g/mol
LogP2.02
Rot. Bonds1

About 5-[5-(trifluoromethyl)-1,3-thiazol-2-yl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one

5-[5-(trifluoromethyl)-1,3-thiazol-2-yl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one (PubChem CID 175970011) has the molecular formula C10H7F3N4OS and a molecular weight of 288.25 g/mol. Its IUPAC name is 5-[5-(trifluoromethyl)-1,3-thiazol-2-yl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one.

Molecular Properties

Compound Name5-[5-(trifluoromethyl)-1,3-thiazol-2-yl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
PubChem CID175970011
Molecular FormulaC10H7F3N4OS
Molecular Weight288.25 g/mol
Exact Mass288.03
IUPAC Name5-[5-(trifluoromethyl)-1,3-thiazol-2-yl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
SMILESO=C1c2ccnn2CCN1c1ncc(C(F)(F)F)s1
InChIInChI=1S/C10H7F3N4OS/c11-10(12,13)7-5-14-9(19-7)16-3-4-17-6(8(16)18)1-2-15-17/h1-2,5H,3-4H2
InChIKeyUEVIXWLZUGEAGF-UHFFFAOYSA-N
XLogP2.02
TPSA51.02 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.25
LogP ≤ 52.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-[5-(trifluoromethyl)-1,3-thiazol-2-yl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one?
The IUPAC name of 5-[5-(trifluoromethyl)-1,3-thiazol-2-yl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one (CID 175970011) is 5-[5-(trifluoromethyl)-1,3-thiazol-2-yl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one.
What is the SMILES notation for 5-[5-(trifluoromethyl)-1,3-thiazol-2-yl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one?
The canonical SMILES for 5-[5-(trifluoromethyl)-1,3-thiazol-2-yl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one is O=C1c2ccnn2CCN1c1ncc(C(F)(F)F)s1.
What is the InChIKey of 5-[5-(trifluoromethyl)-1,3-thiazol-2-yl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one?
The InChIKey is UEVIXWLZUGEAGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7F3N4OS/c11-10(12,13)7-5-14-9(19-7)16-3-4-17-6(8(16)18)1-2-15-17/h1-2,5H,3-4H2.
What are the key properties of 5-[5-(trifluoromethyl)-1,3-thiazol-2-yl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one?
5-[5-(trifluoromethyl)-1,3-thiazol-2-yl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one has a molecular weight of 288.25 g/mol, XLogP of 2.02, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[5-(trifluoromethyl)-1,3-thiazol-2-yl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one is sourced from PubChem (CID 175970011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).