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

C11H17F3N2O3 — CID 107481303

IUPAC1-[2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]acetyl]piperidin-4-one
SMILESO=C1CCN(C(=O)CN(CCO)CC(F)(F)F)CC1
InChIInChI=1S/C11H17F3N2O3/c12-11(13,14)8-15(5-6-17)7-10(19)16-3-1-9(18)2-4-16/h17H,1-8H2
InChIKeyFGTYUMWPVTVCFD-UHFFFAOYSA-N
MW282.26 g/mol
LogP0.03
Rot. Bonds5

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

1-[2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]acetyl]piperidin-4-one (PubChem CID 107481303) has the molecular formula C11H17F3N2O3 and a molecular weight of 282.26 g/mol. Its IUPAC name is 1-[2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]acetyl]piperidin-4-one.

Molecular Properties

Compound Name1-[2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]acetyl]piperidin-4-one
PubChem CID107481303
Molecular FormulaC11H17F3N2O3
Molecular Weight282.26 g/mol
Exact Mass282.12
IUPAC Name1-[2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]acetyl]piperidin-4-one
SMILESO=C1CCN(C(=O)CN(CCO)CC(F)(F)F)CC1
InChIInChI=1S/C11H17F3N2O3/c12-11(13,14)8-15(5-6-17)7-10(19)16-3-1-9(18)2-4-16/h17H,1-8H2
InChIKeyFGTYUMWPVTVCFD-UHFFFAOYSA-N
XLogP0.03
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.26
LogP ≤ 50.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[2-[2-hydroxyethyl(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

Related Compounds

1-[2-[Ethyl(2,2,2-trifluoroethyl)amino]acetyl]piperidin-4-one
CID 55010355
1-[2-[Propyl(2,2,2-trifluoroethyl)amino]acetyl]piperidin-4-one
CID 55010508
2-(3-hydroxypiperidin-1-yl)-N-methyl-N-(2,2,2-trifluoroethyl)acetamide
CID 60496862
2-(4-hydroxypiperidin-1-yl)-N-methyl-N-(2,2,2-trifluoroethyl)acetamide
CID 60501359
1-[2-[Methyl(3,3,3-trifluoropropyl)amino]acetyl]piperidin-4-one
CID 65538826
4,4,4-Trifluoro-1-[4-(2-hydroxyethyl)piperazin-1-yl]butan-1-one
CID 65710962
2-[2,2-Difluoroethyl(methyl)amino]-1-(4-hydroxypiperidin-1-yl)ethanone
CID 71922462
1-(4-Hydroxypiperidin-1-yl)-2-[methyl(2,2,2-trifluoroethyl)amino]ethanone
CID 71973080
1-Piperidin-1-yl-2-[4-(3,3,3-trifluoro-2-hydroxypropyl)piperazin-1-yl]propan-1-one
CID 75507577
2-[2-Hydroxyethyl(propyl)amino]-1-[3-(trifluoromethyl)piperidin-1-yl]ethanone
CID 78896994
(2S)-1-piperidin-1-yl-2-[4-[(2S)-3,3,3-trifluoro-2-hydroxypropyl]piperazin-1-yl]propan-1-one
CID 97833143
(2R)-1-piperidin-1-yl-2-[4-[(2S)-3,3,3-trifluoro-2-hydroxypropyl]piperazin-1-yl]propan-1-one
CID 97833144

Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]acetyl]piperidin-4-one?
The IUPAC name of 1-[2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]acetyl]piperidin-4-one (CID 107481303) is 1-[2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]acetyl]piperidin-4-one.
What is the SMILES notation for 1-[2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]acetyl]piperidin-4-one?
The canonical SMILES for 1-[2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]acetyl]piperidin-4-one is O=C1CCN(C(=O)CN(CCO)CC(F)(F)F)CC1.
What is the InChIKey of 1-[2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]acetyl]piperidin-4-one?
The InChIKey is FGTYUMWPVTVCFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17F3N2O3/c12-11(13,14)8-15(5-6-17)7-10(19)16-3-1-9(18)2-4-16/h17H,1-8H2.
What are the key properties of 1-[2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]acetyl]piperidin-4-one?
1-[2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]acetyl]piperidin-4-one has a molecular weight of 282.26 g/mol, XLogP of 0.03, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]acetyl]piperidin-4-one is sourced from PubChem (CID 107481303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).