(2R)-2-hydroxy-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]acetamide

C9H15F3N2O2 — CID 129489847

IUPAC(2R)-2-hydroxy-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]acetamide
SMILESNC(=O)[C@H](O)C1CCN(CC(F)(F)F)CC1
InChIInChI=1S/C9H15F3N2O2/c10-9(11,12)5-14-3-1-6(2-4-14)7(15)8(13)16/h6-7,15H,1-5H2,(H2,13,16)/t7-/m1/s1
InChIKeyCOLPBXQFGCXOFI-SSDOTTSWSA-N
MW240.22 g/mol
LogP0.11
Rot. Bonds3

About (2R)-2-hydroxy-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]acetamide

(2R)-2-hydroxy-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]acetamide (PubChem CID 129489847) has the molecular formula C9H15F3N2O2 and a molecular weight of 240.22 g/mol. Its IUPAC name is (2R)-2-hydroxy-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]acetamide.

Molecular Properties

Compound Name(2R)-2-hydroxy-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]acetamide
PubChem CID129489847
Molecular FormulaC9H15F3N2O2
Molecular Weight240.22 g/mol
Exact Mass240.11
IUPAC Name(2R)-2-hydroxy-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]acetamide
SMILESNC(=O)[C@H](O)C1CCN(CC(F)(F)F)CC1
InChIInChI=1S/C9H15F3N2O2/c10-9(11,12)5-14-3-1-6(2-4-14)7(15)8(13)16/h6-7,15H,1-5H2,(H2,13,16)/t7-/m1/s1
InChIKeyCOLPBXQFGCXOFI-SSDOTTSWSA-N
XLogP0.11
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.22
LogP ≤ 50.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-2-hydroxy-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]acetamide
CID 154753718
methyl 2-amino-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]acetate
CID 166176346
(2S)-2-amino-3-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]propanoic acid
CID 177277776
(2S)-2-[1-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]piperidin-4-yl]-2-hydroxyacetamide
CID 129489869
(2R)-2-hydroxy-2-[1-[[4-(hydroxymethyl)phenyl]methyl]piperidin-4-yl]acetamide
CID 129490248
(2R)-2-[1-(4-cyano-4-methylpentyl)piperidin-4-yl]-2-hydroxyacetamide
CID 129490237
2-(propylamino)-3-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]propanamide
CID 62968259
2-methyl-2-[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]propanamide
CID 61218639
(3S)-1-[1-(2,2,2-trifluoroethyl)piperidine-4-carbonyl]pyrrolidine-3-carboxamide
CID 94512781
ethyl 3-hydroxy-4-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]butanoate
CID 82768968
N-ethyl-1-(2,2,2-trifluoroethyl)piperidine-4-carboxamide
CID 51077622
methyl 2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]acetate
CID 122164232

Frequently Asked Questions

What is the IUPAC name of (2R)-2-hydroxy-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]acetamide?
The IUPAC name of (2R)-2-hydroxy-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]acetamide (CID 129489847) is (2R)-2-hydroxy-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]acetamide.
What is the SMILES notation for (2R)-2-hydroxy-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]acetamide?
The canonical SMILES for (2R)-2-hydroxy-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]acetamide is NC(=O)[C@H](O)C1CCN(CC(F)(F)F)CC1.
What is the InChIKey of (2R)-2-hydroxy-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]acetamide?
The InChIKey is COLPBXQFGCXOFI-SSDOTTSWSA-N. The full InChI is InChI=1S/C9H15F3N2O2/c10-9(11,12)5-14-3-1-6(2-4-14)7(15)8(13)16/h6-7,15H,1-5H2,(H2,13,16)/t7-/m1/s1.
What are the key properties of (2R)-2-hydroxy-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]acetamide?
(2R)-2-hydroxy-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]acetamide has a molecular weight of 240.22 g/mol, XLogP of 0.11, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-hydroxy-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]acetamide is sourced from PubChem (CID 129489847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).