4-[3-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]piperidin-4-ol

C15H15F3N4O2 — CID 172634886

IUPAC4-[3-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]piperidin-4-ol
SMILESOC1(c2nccnc2Oc2ccc(C(F)(F)F)nc2)CCNCC1
InChIInChI=1S/C15H15F3N4O2/c16-15(17,18)11-2-1-10(9-22-11)24-13-12(20-7-8-21-13)14(23)3-5-19-6-4-14/h1-2,7-9,19,23H,3-6H2
InChIKeyFEFUPMDOFSKRIL-UHFFFAOYSA-N
MW340.31 g/mol
LogP2.25
Rot. Bonds3

About 4-[3-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]piperidin-4-ol

4-[3-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]piperidin-4-ol (PubChem CID 172634886) has the molecular formula C15H15F3N4O2 and a molecular weight of 340.31 g/mol. Its IUPAC name is 4-[3-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]piperidin-4-ol.

Molecular Properties

Compound Name4-[3-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]piperidin-4-ol
PubChem CID172634886
Molecular FormulaC15H15F3N4O2
Molecular Weight340.31 g/mol
Exact Mass340.11
IUPAC Name4-[3-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]piperidin-4-ol
SMILESOC1(c2nccnc2Oc2ccc(C(F)(F)F)nc2)CCNCC1
InChIInChI=1S/C15H15F3N4O2/c16-15(17,18)11-2-1-10(9-22-11)24-13-12(20-7-8-21-13)14(23)3-5-19-6-4-14/h1-2,7-9,19,23H,3-6H2
InChIKeyFEFUPMDOFSKRIL-UHFFFAOYSA-N
XLogP2.25
TPSA80.16 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.31
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-[3-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]piperidin-4-ol?
The IUPAC name of 4-[3-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]piperidin-4-ol (CID 172634886) is 4-[3-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]piperidin-4-ol.
What is the SMILES notation for 4-[3-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]piperidin-4-ol?
The canonical SMILES for 4-[3-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]piperidin-4-ol is OC1(c2nccnc2Oc2ccc(C(F)(F)F)nc2)CCNCC1.
What is the InChIKey of 4-[3-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]piperidin-4-ol?
The InChIKey is FEFUPMDOFSKRIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F3N4O2/c16-15(17,18)11-2-1-10(9-22-11)24-13-12(20-7-8-21-13)14(23)3-5-19-6-4-14/h1-2,7-9,19,23H,3-6H2.
What are the key properties of 4-[3-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]piperidin-4-ol?
4-[3-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]piperidin-4-ol has a molecular weight of 340.31 g/mol, XLogP of 2.25, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]piperidin-4-ol is sourced from PubChem (CID 172634886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).