2-[(2-methylpropan-2-yl)oxy]-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide

C13H23F3N2O2 — CID 115949322

IUPAC2-[(2-methylpropan-2-yl)oxy]-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide
SMILESCC(C)(C)OCC(=O)N(CC(F)(F)F)C1CCNCC1
InChIInChI=1S/C13H23F3N2O2/c1-12(2,3)20-8-11(19)18(9-13(14,15)16)10-4-6-17-7-5-10/h10,17H,4-9H2,1-3H3
InChIKeyQDFLZMJMGPGISM-UHFFFAOYSA-N
MW296.33 g/mol
LogP1.94
Rot. Bonds4

About 2-[(2-methylpropan-2-yl)oxy]-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide

2-[(2-methylpropan-2-yl)oxy]-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 115949322) has the molecular formula C13H23F3N2O2 and a molecular weight of 296.33 g/mol. Its IUPAC name is 2-[(2-methylpropan-2-yl)oxy]-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound Name2-[(2-methylpropan-2-yl)oxy]-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID115949322
Molecular FormulaC13H23F3N2O2
Molecular Weight296.33 g/mol
Exact Mass296.17
IUPAC Name2-[(2-methylpropan-2-yl)oxy]-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide
SMILESCC(C)(C)OCC(=O)N(CC(F)(F)F)C1CCNCC1
InChIInChI=1S/C13H23F3N2O2/c1-12(2,3)20-8-11(19)18(9-13(14,15)16)10-4-6-17-7-5-10/h10,17H,4-9H2,1-3H3
InChIKeyQDFLZMJMGPGISM-UHFFFAOYSA-N
XLogP1.94
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.33
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[(2-methylpropan-2-yl)oxy]-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide 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 2-[(2-methylpropan-2-yl)oxy]-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of 2-[(2-methylpropan-2-yl)oxy]-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide (CID 115949322) is 2-[(2-methylpropan-2-yl)oxy]-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for 2-[(2-methylpropan-2-yl)oxy]-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for 2-[(2-methylpropan-2-yl)oxy]-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide is CC(C)(C)OCC(=O)N(CC(F)(F)F)C1CCNCC1.
What is the InChIKey of 2-[(2-methylpropan-2-yl)oxy]-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is QDFLZMJMGPGISM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23F3N2O2/c1-12(2,3)20-8-11(19)18(9-13(14,15)16)10-4-6-17-7-5-10/h10,17H,4-9H2,1-3H3.
What are the key properties of 2-[(2-methylpropan-2-yl)oxy]-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide?
2-[(2-methylpropan-2-yl)oxy]-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 296.33 g/mol, XLogP of 1.94, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methylpropan-2-yl)oxy]-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 115949322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).