4-[[2-piperidin-4-yloxy-6-(trifluoromethyl)-4-pyridinyl]methyl]morpholine

C16H22F3N3O2 — CID 67615542

IUPAC4-[[2-piperidin-4-yloxy-6-(trifluoromethyl)-4-pyridinyl]methyl]morpholine
SMILESFC(F)(F)c1cc(CN2CCOCC2)cc(OC2CCNCC2)n1
InChIInChI=1S/C16H22F3N3O2/c17-16(18,19)14-9-12(11-22-5-7-23-8-6-22)10-15(21-14)24-13-1-3-20-4-2-13/h9-10,13,20H,1-8,11H2
InChIKeyPHCJKJMHVMDVKK-UHFFFAOYSA-N
MW345.37 g/mol
LogP2.06
Rot. Bonds4

About 4-[[2-piperidin-4-yloxy-6-(trifluoromethyl)-4-pyridinyl]methyl]morpholine

4-[[2-piperidin-4-yloxy-6-(trifluoromethyl)-4-pyridinyl]methyl]morpholine (PubChem CID 67615542) has the molecular formula C16H22F3N3O2 and a molecular weight of 345.37 g/mol. Its IUPAC name is 4-[[2-piperidin-4-yloxy-6-(trifluoromethyl)-4-pyridinyl]methyl]morpholine.

Molecular Properties

Compound Name4-[[2-piperidin-4-yloxy-6-(trifluoromethyl)-4-pyridinyl]methyl]morpholine
PubChem CID67615542
Molecular FormulaC16H22F3N3O2
Molecular Weight345.37 g/mol
Exact Mass345.17
IUPAC Name4-[[2-piperidin-4-yloxy-6-(trifluoromethyl)-4-pyridinyl]methyl]morpholine
SMILESFC(F)(F)c1cc(CN2CCOCC2)cc(OC2CCNCC2)n1
InChIInChI=1S/C16H22F3N3O2/c17-16(18,19)14-9-12(11-22-5-7-23-8-6-22)10-15(21-14)24-13-1-3-20-4-2-13/h9-10,13,20H,1-8,11H2
InChIKeyPHCJKJMHVMDVKK-UHFFFAOYSA-N
XLogP2.06
TPSA46.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.37
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[[2-piperidin-4-yloxy-6-(trifluoromethyl)-4-pyridinyl]methyl]morpholine?
The IUPAC name of 4-[[2-piperidin-4-yloxy-6-(trifluoromethyl)-4-pyridinyl]methyl]morpholine (CID 67615542) is 4-[[2-piperidin-4-yloxy-6-(trifluoromethyl)-4-pyridinyl]methyl]morpholine.
What is the SMILES notation for 4-[[2-piperidin-4-yloxy-6-(trifluoromethyl)-4-pyridinyl]methyl]morpholine?
The canonical SMILES for 4-[[2-piperidin-4-yloxy-6-(trifluoromethyl)-4-pyridinyl]methyl]morpholine is FC(F)(F)c1cc(CN2CCOCC2)cc(OC2CCNCC2)n1.
What is the InChIKey of 4-[[2-piperidin-4-yloxy-6-(trifluoromethyl)-4-pyridinyl]methyl]morpholine?
The InChIKey is PHCJKJMHVMDVKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22F3N3O2/c17-16(18,19)14-9-12(11-22-5-7-23-8-6-22)10-15(21-14)24-13-1-3-20-4-2-13/h9-10,13,20H,1-8,11H2.
What are the key properties of 4-[[2-piperidin-4-yloxy-6-(trifluoromethyl)-4-pyridinyl]methyl]morpholine?
4-[[2-piperidin-4-yloxy-6-(trifluoromethyl)-4-pyridinyl]methyl]morpholine has a molecular weight of 345.37 g/mol, XLogP of 2.06, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-piperidin-4-yloxy-6-(trifluoromethyl)-4-pyridinyl]methyl]morpholine is sourced from PubChem (CID 67615542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).