1-[2-[ethyl(2,2,2-trifluoroethyl)amino]acetyl]piperidin-4-one

C11H17F3N2O2 — CID 55010355

IUPAC1-[2-[ethyl(2,2,2-trifluoroethyl)amino]acetyl]piperidin-4-one
SMILESCCN(CC(=O)N1CCC(=O)CC1)CC(F)(F)F
InChIInChI=1S/C11H17F3N2O2/c1-2-15(8-11(12,13)14)7-10(18)16-5-3-9(17)4-6-16/h2-8H2,1H3
InChIKeyXQSKHFKPIIRTIC-UHFFFAOYSA-N
MW266.26 g/mol
LogP1.06
Rot. Bonds4

About 1-[2-[ethyl(2,2,2-trifluoroethyl)amino]acetyl]piperidin-4-one

1-[2-[ethyl(2,2,2-trifluoroethyl)amino]acetyl]piperidin-4-one (PubChem CID 55010355) has the molecular formula C11H17F3N2O2 and a molecular weight of 266.26 g/mol. Its IUPAC name is 1-[2-[ethyl(2,2,2-trifluoroethyl)amino]acetyl]piperidin-4-one.

Molecular Properties

Compound Name1-[2-[ethyl(2,2,2-trifluoroethyl)amino]acetyl]piperidin-4-one
PubChem CID55010355
Molecular FormulaC11H17F3N2O2
Molecular Weight266.26 g/mol
Exact Mass266.12
IUPAC Name1-[2-[ethyl(2,2,2-trifluoroethyl)amino]acetyl]piperidin-4-one
SMILESCCN(CC(=O)N1CCC(=O)CC1)CC(F)(F)F
InChIInChI=1S/C11H17F3N2O2/c1-2-15(8-11(12,13)14)7-10(18)16-5-3-9(17)4-6-16/h2-8H2,1H3
InChIKeyXQSKHFKPIIRTIC-UHFFFAOYSA-N
XLogP1.06
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.26
LogP ≤ 51.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-[2-[ethyl(2,2,2-trifluoroethyl)amino]acetyl]piperidin-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[2-[ethyl(2,2,2-trifluoroethyl)amino]acetyl]piperidin-4-one?
The IUPAC name of 1-[2-[ethyl(2,2,2-trifluoroethyl)amino]acetyl]piperidin-4-one (CID 55010355) is 1-[2-[ethyl(2,2,2-trifluoroethyl)amino]acetyl]piperidin-4-one.
What is the SMILES notation for 1-[2-[ethyl(2,2,2-trifluoroethyl)amino]acetyl]piperidin-4-one?
The canonical SMILES for 1-[2-[ethyl(2,2,2-trifluoroethyl)amino]acetyl]piperidin-4-one is CCN(CC(=O)N1CCC(=O)CC1)CC(F)(F)F.
What is the InChIKey of 1-[2-[ethyl(2,2,2-trifluoroethyl)amino]acetyl]piperidin-4-one?
The InChIKey is XQSKHFKPIIRTIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17F3N2O2/c1-2-15(8-11(12,13)14)7-10(18)16-5-3-9(17)4-6-16/h2-8H2,1H3.
What are the key properties of 1-[2-[ethyl(2,2,2-trifluoroethyl)amino]acetyl]piperidin-4-one?
1-[2-[ethyl(2,2,2-trifluoroethyl)amino]acetyl]piperidin-4-one has a molecular weight of 266.26 g/mol, XLogP of 1.06, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[ethyl(2,2,2-trifluoroethyl)amino]acetyl]piperidin-4-one is sourced from PubChem (CID 55010355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).