2-(4-methoxypiperidin-1-yl)-N-methyl-N-(2,2,2-trifluoroethyl)acetamide

C11H19F3N2O2 — CID 78898220

IUPAC2-(4-methoxypiperidin-1-yl)-N-methyl-N-(2,2,2-trifluoroethyl)acetamide
SMILESCOC1CCN(CC(=O)N(C)CC(F)(F)F)CC1
InChIInChI=1S/C11H19F3N2O2/c1-15(8-11(12,13)14)10(17)7-16-5-3-9(18-2)4-6-16/h9H,3-8H2,1-2H3
InChIKeyFZCJKVCZVFYVJX-UHFFFAOYSA-N
MW268.28 g/mol
LogP1.12
Rot. Bonds4

About 2-(4-methoxypiperidin-1-yl)-N-methyl-N-(2,2,2-trifluoroethyl)acetamide

2-(4-methoxypiperidin-1-yl)-N-methyl-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 78898220) has the molecular formula C11H19F3N2O2 and a molecular weight of 268.28 g/mol. Its IUPAC name is 2-(4-methoxypiperidin-1-yl)-N-methyl-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound Name2-(4-methoxypiperidin-1-yl)-N-methyl-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID78898220
Molecular FormulaC11H19F3N2O2
Molecular Weight268.28 g/mol
Exact Mass268.14
IUPAC Name2-(4-methoxypiperidin-1-yl)-N-methyl-N-(2,2,2-trifluoroethyl)acetamide
SMILESCOC1CCN(CC(=O)N(C)CC(F)(F)F)CC1
InChIInChI=1S/C11H19F3N2O2/c1-15(8-11(12,13)14)10(17)7-16-5-3-9(18-2)4-6-16/h9H,3-8H2,1-2H3
InChIKeyFZCJKVCZVFYVJX-UHFFFAOYSA-N
XLogP1.12
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.28
LogP ≤ 51.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,2,2-Trifluoro-1-(cis-3-fluoro-4-methoxypiperidin-1-yl)ethan-1-one
CID 134827899
1-(Azepan-1-yl)-2-(4-methoxypiperidin-1-yl)ethanone
CID 47015941
2-(4-Methoxypiperidin-1-yl)-1-piperidin-1-ylethanone
CID 53524569
1-(2,6-Dimethylmorpholin-4-yl)-2-[propyl(2,2,2-trifluoroethyl)amino]ethanone
CID 72017177
1-[2-(4-Methoxypiperidin-1-yl)-2-oxoethyl]azepane
CID 131899023
2,2,2-Trifluoro-1-(4-methoxypiperidin-1-yl)ethanone
CID 58896716
1-(4-Ethoxypiperidin-1-yl)-2,2,2-trifluoroethanone
CID 62726538
1-[4-(2,2,2-Trifluoroethoxy)piperidin-1-yl]ethanone
CID 68211716
2,2,2-Trifluoro-1-(4-propan-2-yloxypiperidin-1-yl)ethanone
CID 88915727
2,2-Difluoro-1-(4-methoxypiperidin-1-yl)ethanone
CID 103514742
2,2-Difluoro-1-(4-propan-2-yloxypiperidin-1-yl)ethanone
CID 118551852
2,2-difluoro-1-[(3R,4S)-3-fluoro-4-propan-2-yloxypiperidin-1-yl]ethanone
CID 121261792

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxypiperidin-1-yl)-N-methyl-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of 2-(4-methoxypiperidin-1-yl)-N-methyl-N-(2,2,2-trifluoroethyl)acetamide (CID 78898220) is 2-(4-methoxypiperidin-1-yl)-N-methyl-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for 2-(4-methoxypiperidin-1-yl)-N-methyl-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for 2-(4-methoxypiperidin-1-yl)-N-methyl-N-(2,2,2-trifluoroethyl)acetamide is COC1CCN(CC(=O)N(C)CC(F)(F)F)CC1.
What is the InChIKey of 2-(4-methoxypiperidin-1-yl)-N-methyl-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is FZCJKVCZVFYVJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19F3N2O2/c1-15(8-11(12,13)14)10(17)7-16-5-3-9(18-2)4-6-16/h9H,3-8H2,1-2H3.
What are the key properties of 2-(4-methoxypiperidin-1-yl)-N-methyl-N-(2,2,2-trifluoroethyl)acetamide?
2-(4-methoxypiperidin-1-yl)-N-methyl-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 268.28 g/mol, XLogP of 1.12, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxypiperidin-1-yl)-N-methyl-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 78898220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).