2-cyclopropyl-5-[[3-hydroxy-3-(trifluoromethyl)cyclobutyl]methyl]pyrazolo[1,5-a]pyrazin-4-one

C15H16F3N3O2 — CID 167867475

IUPAC2-cyclopropyl-5-[[3-hydroxy-3-(trifluoromethyl)cyclobutyl]methyl]pyrazolo[1,5-a]pyrazin-4-one
SMILESO=c1c2cc(C3CC3)nn2ccn1CC1CC(O)(C(F)(F)F)C1
InChIInChI=1S/C15H16F3N3O2/c16-15(17,18)14(23)6-9(7-14)8-20-3-4-21-12(13(20)22)5-11(19-21)10-1-2-10/h3-5,9-10,23H,1-2,6-8H2
InChIKeyGOCPVYBZORJKPQ-UHFFFAOYSA-N
MW327.31 g/mol
LogP2.08
Rot. Bonds3

About 2-cyclopropyl-5-[[3-hydroxy-3-(trifluoromethyl)cyclobutyl]methyl]pyrazolo[1,5-a]pyrazin-4-one

2-cyclopropyl-5-[[3-hydroxy-3-(trifluoromethyl)cyclobutyl]methyl]pyrazolo[1,5-a]pyrazin-4-one (PubChem CID 167867475) has the molecular formula C15H16F3N3O2 and a molecular weight of 327.31 g/mol. Its IUPAC name is 2-cyclopropyl-5-[[3-hydroxy-3-(trifluoromethyl)cyclobutyl]methyl]pyrazolo[1,5-a]pyrazin-4-one.

Molecular Properties

Compound Name2-cyclopropyl-5-[[3-hydroxy-3-(trifluoromethyl)cyclobutyl]methyl]pyrazolo[1,5-a]pyrazin-4-one
PubChem CID167867475
Molecular FormulaC15H16F3N3O2
Molecular Weight327.31 g/mol
Exact Mass327.12
IUPAC Name2-cyclopropyl-5-[[3-hydroxy-3-(trifluoromethyl)cyclobutyl]methyl]pyrazolo[1,5-a]pyrazin-4-one
SMILESO=c1c2cc(C3CC3)nn2ccn1CC1CC(O)(C(F)(F)F)C1
InChIInChI=1S/C15H16F3N3O2/c16-15(17,18)14(23)6-9(7-14)8-20-3-4-21-12(13(20)22)5-11(19-21)10-1-2-10/h3-5,9-10,23H,1-2,6-8H2
InChIKeyGOCPVYBZORJKPQ-UHFFFAOYSA-N
XLogP2.08
TPSA59.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.31
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-cyclopropyl-5-[[3-hydroxy-3-(trifluoromethyl)cyclobutyl]methyl]pyrazolo[1,5-a]pyrazin-4-one 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-cyclopropyl-5-[[3-hydroxy-3-(trifluoromethyl)cyclobutyl]methyl]pyrazolo[1,5-a]pyrazin-4-one?
The IUPAC name of 2-cyclopropyl-5-[[3-hydroxy-3-(trifluoromethyl)cyclobutyl]methyl]pyrazolo[1,5-a]pyrazin-4-one (CID 167867475) is 2-cyclopropyl-5-[[3-hydroxy-3-(trifluoromethyl)cyclobutyl]methyl]pyrazolo[1,5-a]pyrazin-4-one.
What is the SMILES notation for 2-cyclopropyl-5-[[3-hydroxy-3-(trifluoromethyl)cyclobutyl]methyl]pyrazolo[1,5-a]pyrazin-4-one?
The canonical SMILES for 2-cyclopropyl-5-[[3-hydroxy-3-(trifluoromethyl)cyclobutyl]methyl]pyrazolo[1,5-a]pyrazin-4-one is O=c1c2cc(C3CC3)nn2ccn1CC1CC(O)(C(F)(F)F)C1.
What is the InChIKey of 2-cyclopropyl-5-[[3-hydroxy-3-(trifluoromethyl)cyclobutyl]methyl]pyrazolo[1,5-a]pyrazin-4-one?
The InChIKey is GOCPVYBZORJKPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16F3N3O2/c16-15(17,18)14(23)6-9(7-14)8-20-3-4-21-12(13(20)22)5-11(19-21)10-1-2-10/h3-5,9-10,23H,1-2,6-8H2.
What are the key properties of 2-cyclopropyl-5-[[3-hydroxy-3-(trifluoromethyl)cyclobutyl]methyl]pyrazolo[1,5-a]pyrazin-4-one?
2-cyclopropyl-5-[[3-hydroxy-3-(trifluoromethyl)cyclobutyl]methyl]pyrazolo[1,5-a]pyrazin-4-one has a molecular weight of 327.31 g/mol, XLogP of 2.08, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-5-[[3-hydroxy-3-(trifluoromethyl)cyclobutyl]methyl]pyrazolo[1,5-a]pyrazin-4-one is sourced from PubChem (CID 167867475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).