2-[5-oxo-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-4-yl]acetamide

C9H7F3N4O2 — CID 68784639

IUPAC2-[5-oxo-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-4-yl]acetamide
SMILESNC(=O)Cn1c(=O)ccn2nc(C(F)(F)F)cc12
InChIInChI=1S/C9H7F3N4O2/c10-9(11,12)5-3-7-15(4-6(13)17)8(18)1-2-16(7)14-5/h1-3H,4H2,(H2,13,17)
InChIKeyLCZRGFBOAGNMCE-UHFFFAOYSA-N
MW260.18 g/mol
LogP0.00
Rot. Bonds2

About 2-[5-oxo-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-4-yl]acetamide

2-[5-oxo-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-4-yl]acetamide (PubChem CID 68784639) has the molecular formula C9H7F3N4O2 and a molecular weight of 260.18 g/mol. Its IUPAC name is 2-[5-oxo-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-4-yl]acetamide.

Molecular Properties

Compound Name2-[5-oxo-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-4-yl]acetamide
PubChem CID68784639
Molecular FormulaC9H7F3N4O2
Molecular Weight260.18 g/mol
Exact Mass260.05
IUPAC Name2-[5-oxo-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-4-yl]acetamide
SMILESNC(=O)Cn1c(=O)ccn2nc(C(F)(F)F)cc12
InChIInChI=1S/C9H7F3N4O2/c10-9(11,12)5-3-7-15(4-6(13)17)8(18)1-2-16(7)14-5/h1-3H,4H2,(H2,13,17)
InChIKeyLCZRGFBOAGNMCE-UHFFFAOYSA-N
XLogP0.00
TPSA82.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.18
LogP ≤ 50.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[5-oxo-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-4-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[5-oxo-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-4-yl]acetamide?
The IUPAC name of 2-[5-oxo-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-4-yl]acetamide (CID 68784639) is 2-[5-oxo-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-4-yl]acetamide.
What is the SMILES notation for 2-[5-oxo-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-4-yl]acetamide?
The canonical SMILES for 2-[5-oxo-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-4-yl]acetamide is NC(=O)Cn1c(=O)ccn2nc(C(F)(F)F)cc12.
What is the InChIKey of 2-[5-oxo-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-4-yl]acetamide?
The InChIKey is LCZRGFBOAGNMCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7F3N4O2/c10-9(11,12)5-3-7-15(4-6(13)17)8(18)1-2-16(7)14-5/h1-3H,4H2,(H2,13,17).
What are the key properties of 2-[5-oxo-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-4-yl]acetamide?
2-[5-oxo-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-4-yl]acetamide has a molecular weight of 260.18 g/mol, XLogP of 0.00, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-oxo-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-4-yl]acetamide is sourced from PubChem (CID 68784639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).