[7-amino-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-6-yl]methanol

C8H7F3N4O — CID 58034477

IUPAC[7-amino-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-6-yl]methanol
SMILESNc1c(CO)cnc2cc(C(F)(F)F)nn12
InChIInChI=1S/C8H7F3N4O/c9-8(10,11)5-1-6-13-2-4(3-16)7(12)15(6)14-5/h1-2,16H,3,12H2
InChIKeyJTXYSSQHEJOOGR-UHFFFAOYSA-N
MW232.16 g/mol
LogP0.82
Rot. Bonds1

About [7-amino-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-6-yl]methanol

[7-amino-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-6-yl]methanol (PubChem CID 58034477) has the molecular formula C8H7F3N4O and a molecular weight of 232.16 g/mol. Its IUPAC name is [7-amino-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-6-yl]methanol.

Molecular Properties

Compound Name[7-amino-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-6-yl]methanol
PubChem CID58034477
Molecular FormulaC8H7F3N4O
Molecular Weight232.16 g/mol
Exact Mass232.06
IUPAC Name[7-amino-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-6-yl]methanol
SMILESNc1c(CO)cnc2cc(C(F)(F)F)nn12
InChIInChI=1S/C8H7F3N4O/c9-8(10,11)5-1-6-13-2-4(3-16)7(12)15(6)14-5/h1-2,16H,3,12H2
InChIKeyJTXYSSQHEJOOGR-UHFFFAOYSA-N
XLogP0.82
TPSA76.44 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.16
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze [7-amino-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-6-yl]methanol 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 [7-amino-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-6-yl]methanol?
The IUPAC name of [7-amino-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-6-yl]methanol (CID 58034477) is [7-amino-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-6-yl]methanol.
What is the SMILES notation for [7-amino-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-6-yl]methanol?
The canonical SMILES for [7-amino-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-6-yl]methanol is Nc1c(CO)cnc2cc(C(F)(F)F)nn12.
What is the InChIKey of [7-amino-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-6-yl]methanol?
The InChIKey is JTXYSSQHEJOOGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7F3N4O/c9-8(10,11)5-1-6-13-2-4(3-16)7(12)15(6)14-5/h1-2,16H,3,12H2.
What are the key properties of [7-amino-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-6-yl]methanol?
[7-amino-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-6-yl]methanol has a molecular weight of 232.16 g/mol, XLogP of 0.82, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [7-amino-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-6-yl]methanol is sourced from PubChem (CID 58034477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).