4-[1-[4-(trifluoromethyl)-2-pyridinyl]piperidin-3-yl]morpholine

C15H20F3N3O — CID 56883139

IUPAC4-[1-[4-(trifluoromethyl)-2-pyridinyl]piperidin-3-yl]morpholine
SMILESFC(F)(F)c1ccnc(N2CCCC(N3CCOCC3)C2)c1
InChIInChI=1S/C15H20F3N3O/c16-15(17,18)12-3-4-19-14(10-12)21-5-1-2-13(11-21)20-6-8-22-9-7-20/h3-4,10,13H,1-2,5-9,11H2
InChIKeyGYFDQEFTLUUYAV-UHFFFAOYSA-N
MW315.34 g/mol
LogP2.40
Rot. Bonds2

About 4-[1-[4-(trifluoromethyl)-2-pyridinyl]piperidin-3-yl]morpholine

4-[1-[4-(trifluoromethyl)-2-pyridinyl]piperidin-3-yl]morpholine (PubChem CID 56883139) has the molecular formula C15H20F3N3O and a molecular weight of 315.34 g/mol. Its IUPAC name is 4-[1-[4-(trifluoromethyl)-2-pyridinyl]piperidin-3-yl]morpholine.

Molecular Properties

Compound Name4-[1-[4-(trifluoromethyl)-2-pyridinyl]piperidin-3-yl]morpholine
PubChem CID56883139
Molecular FormulaC15H20F3N3O
Molecular Weight315.34 g/mol
Exact Mass315.16
IUPAC Name4-[1-[4-(trifluoromethyl)-2-pyridinyl]piperidin-3-yl]morpholine
SMILESFC(F)(F)c1ccnc(N2CCCC(N3CCOCC3)C2)c1
InChIInChI=1S/C15H20F3N3O/c16-15(17,18)12-3-4-19-14(10-12)21-5-1-2-13(11-21)20-6-8-22-9-7-20/h3-4,10,13H,1-2,5-9,11H2
InChIKeyGYFDQEFTLUUYAV-UHFFFAOYSA-N
XLogP2.40
TPSA28.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.34
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[1-[4-(trifluoromethyl)-2-pyridinyl]piperidin-3-yl]morpholine?
The IUPAC name of 4-[1-[4-(trifluoromethyl)-2-pyridinyl]piperidin-3-yl]morpholine (CID 56883139) is 4-[1-[4-(trifluoromethyl)-2-pyridinyl]piperidin-3-yl]morpholine.
What is the SMILES notation for 4-[1-[4-(trifluoromethyl)-2-pyridinyl]piperidin-3-yl]morpholine?
The canonical SMILES for 4-[1-[4-(trifluoromethyl)-2-pyridinyl]piperidin-3-yl]morpholine is FC(F)(F)c1ccnc(N2CCCC(N3CCOCC3)C2)c1.
What is the InChIKey of 4-[1-[4-(trifluoromethyl)-2-pyridinyl]piperidin-3-yl]morpholine?
The InChIKey is GYFDQEFTLUUYAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20F3N3O/c16-15(17,18)12-3-4-19-14(10-12)21-5-1-2-13(11-21)20-6-8-22-9-7-20/h3-4,10,13H,1-2,5-9,11H2.
What are the key properties of 4-[1-[4-(trifluoromethyl)-2-pyridinyl]piperidin-3-yl]morpholine?
4-[1-[4-(trifluoromethyl)-2-pyridinyl]piperidin-3-yl]morpholine has a molecular weight of 315.34 g/mol, XLogP of 2.40, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-[4-(trifluoromethyl)-2-pyridinyl]piperidin-3-yl]morpholine is sourced from PubChem (CID 56883139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).