2,6-dimethyl-4-[2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]morpholine

C15H27F3N2O — CID 71861447

IUPAC2,6-dimethyl-4-[2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]morpholine
SMILESCC1CN(CCC2CCN(CC(F)(F)F)CC2)CC(C)O1
InChIInChI=1S/C15H27F3N2O/c1-12-9-20(10-13(2)21-12)8-5-14-3-6-19(7-4-14)11-15(16,17)18/h12-14H,3-11H2,1-2H3
InChIKeyYXFJDYBIHYYYGS-UHFFFAOYSA-N
MW308.39 g/mol
LogP2.76
Rot. Bonds4

About 2,6-dimethyl-4-[2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]morpholine

2,6-dimethyl-4-[2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]morpholine (PubChem CID 71861447) has the molecular formula C15H27F3N2O and a molecular weight of 308.39 g/mol. Its IUPAC name is 2,6-dimethyl-4-[2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]morpholine.

Molecular Properties

Compound Name2,6-dimethyl-4-[2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]morpholine
PubChem CID71861447
Molecular FormulaC15H27F3N2O
Molecular Weight308.39 g/mol
Exact Mass308.21
IUPAC Name2,6-dimethyl-4-[2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]morpholine
SMILESCC1CN(CCC2CCN(CC(F)(F)F)CC2)CC(C)O1
InChIInChI=1S/C15H27F3N2O/c1-12-9-20(10-13(2)21-12)8-5-14-3-6-19(7-4-14)11-15(16,17)18/h12-14H,3-11H2,1-2H3
InChIKeyYXFJDYBIHYYYGS-UHFFFAOYSA-N
XLogP2.76
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.39
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-[[1-(2-Methylpropyl)piperidin-4-yl]methyl]morpholine
CID 47053722
1,1,1-Trifluoro-2-methyl-3-[3-(morpholin-4-ylmethyl)piperidin-1-yl]propan-2-ol
CID 121536491
1-(3-Ethoxy-1,1,2,2,3,3-hexafluoropropyl)-4-methylpiperidine;4-(1,1,2,2,3,3-hexafluoro-3-methoxypropyl)-2,6-dimethylmorpholine
CID 54393529
2-Propan-2-yl-4-(3,3,3-trifluoropropyl)morpholine
CID 58468999
1-[2-(1,1,1-Trifluoro-3-methylbutan-2-yl)oxyethyl]piperidine
CID 59203952
1-[2-(1,1,1,2,2-Pentafluoro-4-methylpentan-3-yl)oxyethyl]piperidine
CID 59204134
2-Propan-2-yl-4-(2,2,2-trifluoroethyl)morpholine
CID 68221815
1-(3-Ethoxy-1,1,2,2,3,3-hexafluoropropyl)-4-methylpiperidine;1-methyl-4-(1,1,2,2-tetrafluoro-2-methoxyethyl)piperazine
CID 90801681
2-[1-(4,4-Difluoropiperidin-1-yl)-2-methylpropan-2-yl]-4-(2-methylpropyl)morpholine
CID 130368442
2-[3-(4,4-Difluoropiperidin-1-yl)-2-methylpropyl]-4-(2-methylpropyl)morpholine
CID 130368452
4-Methyl-1-[2-(trifluoromethoxy)ethyl]piperidine
CID 130420846
3,3-Difluoro-1-(2-methoxyethyl)-4-methylpiperidine
CID 131152778

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-4-[2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]morpholine?
The IUPAC name of 2,6-dimethyl-4-[2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]morpholine (CID 71861447) is 2,6-dimethyl-4-[2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]morpholine.
What is the SMILES notation for 2,6-dimethyl-4-[2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]morpholine?
The canonical SMILES for 2,6-dimethyl-4-[2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]morpholine is CC1CN(CCC2CCN(CC(F)(F)F)CC2)CC(C)O1.
What is the InChIKey of 2,6-dimethyl-4-[2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]morpholine?
The InChIKey is YXFJDYBIHYYYGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27F3N2O/c1-12-9-20(10-13(2)21-12)8-5-14-3-6-19(7-4-14)11-15(16,17)18/h12-14H,3-11H2,1-2H3.
What are the key properties of 2,6-dimethyl-4-[2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]morpholine?
2,6-dimethyl-4-[2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]morpholine has a molecular weight of 308.39 g/mol, XLogP of 2.76, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-4-[2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]morpholine is sourced from PubChem (CID 71861447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).