5-[1-[6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl]oxypyrazolo[1,5-a]pyrimidine

C16H15F3N6O — CID 163354817

IUPAC5-[1-[6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl]oxypyrazolo[1,5-a]pyrimidine
SMILESFC(F)(F)c1cc(N2CCC(Oc3ccn4nccc4n3)CC2)ncn1
InChIInChI=1S/C16H15F3N6O/c17-16(18,19)12-9-14(21-10-20-12)24-6-2-11(3-7-24)26-15-4-8-25-13(23-15)1-5-22-25/h1,4-5,8-11H,2-3,6-7H2
InChIKeyFLLSVYRFUIMRRD-UHFFFAOYSA-N
MW364.33 g/mol
LogP2.59
Rot. Bonds3

About 5-[1-[6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl]oxypyrazolo[1,5-a]pyrimidine

5-[1-[6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl]oxypyrazolo[1,5-a]pyrimidine (PubChem CID 163354817) has the molecular formula C16H15F3N6O and a molecular weight of 364.33 g/mol. Its IUPAC name is 5-[1-[6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl]oxypyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name5-[1-[6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl]oxypyrazolo[1,5-a]pyrimidine
PubChem CID163354817
Molecular FormulaC16H15F3N6O
Molecular Weight364.33 g/mol
Exact Mass364.13
IUPAC Name5-[1-[6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl]oxypyrazolo[1,5-a]pyrimidine
SMILESFC(F)(F)c1cc(N2CCC(Oc3ccn4nccc4n3)CC2)ncn1
InChIInChI=1S/C16H15F3N6O/c17-16(18,19)12-9-14(21-10-20-12)24-6-2-11(3-7-24)26-15-4-8-25-13(23-15)1-5-22-25/h1,4-5,8-11H,2-3,6-7H2
InChIKeyFLLSVYRFUIMRRD-UHFFFAOYSA-N
XLogP2.59
TPSA68.44 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.33
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 5-[1-[6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl]oxypyrazolo[1,5-a]pyrimidine 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 5-[1-[6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl]oxypyrazolo[1,5-a]pyrimidine?
The IUPAC name of 5-[1-[6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl]oxypyrazolo[1,5-a]pyrimidine (CID 163354817) is 5-[1-[6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl]oxypyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 5-[1-[6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl]oxypyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 5-[1-[6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl]oxypyrazolo[1,5-a]pyrimidine is FC(F)(F)c1cc(N2CCC(Oc3ccn4nccc4n3)CC2)ncn1.
What is the InChIKey of 5-[1-[6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl]oxypyrazolo[1,5-a]pyrimidine?
The InChIKey is FLLSVYRFUIMRRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F3N6O/c17-16(18,19)12-9-14(21-10-20-12)24-6-2-11(3-7-24)26-15-4-8-25-13(23-15)1-5-22-25/h1,4-5,8-11H,2-3,6-7H2.
What are the key properties of 5-[1-[6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl]oxypyrazolo[1,5-a]pyrimidine?
5-[1-[6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl]oxypyrazolo[1,5-a]pyrimidine has a molecular weight of 364.33 g/mol, XLogP of 2.59, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-[6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl]oxypyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 163354817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).