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

C12H21F3N2O — CID 66427085

IUPAC2-[2-[3-(trifluoromethyl)piperidin-1-yl]ethyl]morpholine
SMILESFC(F)(F)C1CCCN(CCC2CNCCO2)C1
InChIInChI=1S/C12H21F3N2O/c13-12(14,15)10-2-1-5-17(9-10)6-3-11-8-16-4-7-18-11/h10-11,16H,1-9H2
InChIKeyAAYYZFBGSRXQMO-UHFFFAOYSA-N
MW266.31 g/mol
LogP1.64
Rot. Bonds3

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

2-[2-[3-(trifluoromethyl)piperidin-1-yl]ethyl]morpholine (PubChem CID 66427085) has the molecular formula C12H21F3N2O and a molecular weight of 266.31 g/mol. Its IUPAC name is 2-[2-[3-(trifluoromethyl)piperidin-1-yl]ethyl]morpholine.

Molecular Properties

Compound Name2-[2-[3-(trifluoromethyl)piperidin-1-yl]ethyl]morpholine
PubChem CID66427085
Molecular FormulaC12H21F3N2O
Molecular Weight266.31 g/mol
Exact Mass266.16
IUPAC Name2-[2-[3-(trifluoromethyl)piperidin-1-yl]ethyl]morpholine
SMILESFC(F)(F)C1CCCN(CCC2CNCCO2)C1
InChIInChI=1S/C12H21F3N2O/c13-12(14,15)10-2-1-5-17(9-10)6-3-11-8-16-4-7-18-11/h10-11,16H,1-9H2
InChIKeyAAYYZFBGSRXQMO-UHFFFAOYSA-N
XLogP1.64
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.31
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[2-[3-(trifluoromethyl)piperidin-1-yl]ethyl]morpholine?
The IUPAC name of 2-[2-[3-(trifluoromethyl)piperidin-1-yl]ethyl]morpholine (CID 66427085) is 2-[2-[3-(trifluoromethyl)piperidin-1-yl]ethyl]morpholine.
What is the SMILES notation for 2-[2-[3-(trifluoromethyl)piperidin-1-yl]ethyl]morpholine?
The canonical SMILES for 2-[2-[3-(trifluoromethyl)piperidin-1-yl]ethyl]morpholine is FC(F)(F)C1CCCN(CCC2CNCCO2)C1.
What is the InChIKey of 2-[2-[3-(trifluoromethyl)piperidin-1-yl]ethyl]morpholine?
The InChIKey is AAYYZFBGSRXQMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21F3N2O/c13-12(14,15)10-2-1-5-17(9-10)6-3-11-8-16-4-7-18-11/h10-11,16H,1-9H2.
What are the key properties of 2-[2-[3-(trifluoromethyl)piperidin-1-yl]ethyl]morpholine?
2-[2-[3-(trifluoromethyl)piperidin-1-yl]ethyl]morpholine has a molecular weight of 266.31 g/mol, XLogP of 1.64, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[3-(trifluoromethyl)piperidin-1-yl]ethyl]morpholine is sourced from PubChem (CID 66427085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).