4-[7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-5-yl]morpholine

C11H11F3N4O — CID 134852626

IUPAC4-[7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-5-yl]morpholine
SMILESFC(F)(F)c1cc(N2CCOCC2)nc2ccnn12
InChIInChI=1S/C11H11F3N4O/c12-11(13,14)8-7-10(17-3-5-19-6-4-17)16-9-1-2-15-18(8)9/h1-2,7H,3-6H2
InChIKeyGPPXFCWXDXDCLV-UHFFFAOYSA-N
MW272.23 g/mol
LogP1.58
Rot. Bonds1

About 4-[7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-5-yl]morpholine

4-[7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-5-yl]morpholine (PubChem CID 134852626) has the molecular formula C11H11F3N4O and a molecular weight of 272.23 g/mol. Its IUPAC name is 4-[7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-5-yl]morpholine.

Molecular Properties

Compound Name4-[7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-5-yl]morpholine
PubChem CID134852626
Molecular FormulaC11H11F3N4O
Molecular Weight272.23 g/mol
Exact Mass272.09
IUPAC Name4-[7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-5-yl]morpholine
SMILESFC(F)(F)c1cc(N2CCOCC2)nc2ccnn12
InChIInChI=1S/C11H11F3N4O/c12-11(13,14)8-7-10(17-3-5-19-6-4-17)16-9-1-2-15-18(8)9/h1-2,7H,3-6H2
InChIKeyGPPXFCWXDXDCLV-UHFFFAOYSA-N
XLogP1.58
TPSA42.66 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.23
LogP ≤ 51.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-5-yl]morpholine?
The IUPAC name of 4-[7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-5-yl]morpholine (CID 134852626) is 4-[7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-5-yl]morpholine.
What is the SMILES notation for 4-[7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-5-yl]morpholine?
The canonical SMILES for 4-[7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-5-yl]morpholine is FC(F)(F)c1cc(N2CCOCC2)nc2ccnn12.
What is the InChIKey of 4-[7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-5-yl]morpholine?
The InChIKey is GPPXFCWXDXDCLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11F3N4O/c12-11(13,14)8-7-10(17-3-5-19-6-4-17)16-9-1-2-15-18(8)9/h1-2,7H,3-6H2.
What are the key properties of 4-[7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-5-yl]morpholine?
4-[7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-5-yl]morpholine has a molecular weight of 272.23 g/mol, XLogP of 1.58, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-5-yl]morpholine is sourced from PubChem (CID 134852626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).