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

C11H19F3N2O — CID 64534654

IUPAC2-[[3-(trifluoromethyl)piperidin-1-yl]methyl]morpholine
SMILESFC(F)(F)C1CCCN(CC2CNCCO2)C1
InChIInChI=1S/C11H19F3N2O/c12-11(13,14)9-2-1-4-16(7-9)8-10-6-15-3-5-17-10/h9-10,15H,1-8H2
InChIKeyWUKUGOGHSPBNQX-UHFFFAOYSA-N
MW252.28 g/mol
LogP1.25
Rot. Bonds2

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

2-[[3-(trifluoromethyl)piperidin-1-yl]methyl]morpholine (PubChem CID 64534654) has the molecular formula C11H19F3N2O and a molecular weight of 252.28 g/mol. Its IUPAC name is 2-[[3-(trifluoromethyl)piperidin-1-yl]methyl]morpholine.

Molecular Properties

Compound Name2-[[3-(trifluoromethyl)piperidin-1-yl]methyl]morpholine
PubChem CID64534654
Molecular FormulaC11H19F3N2O
Molecular Weight252.28 g/mol
Exact Mass252.14
IUPAC Name2-[[3-(trifluoromethyl)piperidin-1-yl]methyl]morpholine
SMILESFC(F)(F)C1CCCN(CC2CNCCO2)C1
InChIInChI=1S/C11H19F3N2O/c12-11(13,14)9-2-1-4-16(7-9)8-10-6-15-3-5-17-10/h9-10,15H,1-8H2
InChIKeyWUKUGOGHSPBNQX-UHFFFAOYSA-N
XLogP1.25
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.28
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[[3-(trifluoromethyl)piperidin-1-yl]methyl]morpholine?
The IUPAC name of 2-[[3-(trifluoromethyl)piperidin-1-yl]methyl]morpholine (CID 64534654) is 2-[[3-(trifluoromethyl)piperidin-1-yl]methyl]morpholine.
What is the SMILES notation for 2-[[3-(trifluoromethyl)piperidin-1-yl]methyl]morpholine?
The canonical SMILES for 2-[[3-(trifluoromethyl)piperidin-1-yl]methyl]morpholine is FC(F)(F)C1CCCN(CC2CNCCO2)C1.
What is the InChIKey of 2-[[3-(trifluoromethyl)piperidin-1-yl]methyl]morpholine?
The InChIKey is WUKUGOGHSPBNQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19F3N2O/c12-11(13,14)9-2-1-4-16(7-9)8-10-6-15-3-5-17-10/h9-10,15H,1-8H2.
What are the key properties of 2-[[3-(trifluoromethyl)piperidin-1-yl]methyl]morpholine?
2-[[3-(trifluoromethyl)piperidin-1-yl]methyl]morpholine has a molecular weight of 252.28 g/mol, XLogP of 1.25, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[3-(trifluoromethyl)piperidin-1-yl]methyl]morpholine is sourced from PubChem (CID 64534654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).