1-(4-hydroxypiperidin-1-yl)-2-[methyl(2,2,2-trifluoroethyl)amino]ethanone

C10H17F3N2O2 — CID 71973080

IUPAC1-(4-hydroxypiperidin-1-yl)-2-[methyl(2,2,2-trifluoroethyl)amino]ethanone
SMILESCN(CC(=O)N1CCC(O)CC1)CC(F)(F)F
InChIInChI=1S/C10H17F3N2O2/c1-14(7-10(11,12)13)6-9(17)15-4-2-8(16)3-5-15/h8,16H,2-7H2,1H3
InChIKeyLPOHMRTZEAQQGR-UHFFFAOYSA-N
MW254.25 g/mol
LogP0.46
Rot. Bonds3

About 1-(4-hydroxypiperidin-1-yl)-2-[methyl(2,2,2-trifluoroethyl)amino]ethanone

1-(4-hydroxypiperidin-1-yl)-2-[methyl(2,2,2-trifluoroethyl)amino]ethanone (PubChem CID 71973080) has the molecular formula C10H17F3N2O2 and a molecular weight of 254.25 g/mol. Its IUPAC name is 1-(4-hydroxypiperidin-1-yl)-2-[methyl(2,2,2-trifluoroethyl)amino]ethanone.

Molecular Properties

Compound Name1-(4-hydroxypiperidin-1-yl)-2-[methyl(2,2,2-trifluoroethyl)amino]ethanone
PubChem CID71973080
Molecular FormulaC10H17F3N2O2
Molecular Weight254.25 g/mol
Exact Mass254.12
IUPAC Name1-(4-hydroxypiperidin-1-yl)-2-[methyl(2,2,2-trifluoroethyl)amino]ethanone
SMILESCN(CC(=O)N1CCC(O)CC1)CC(F)(F)F
InChIInChI=1S/C10H17F3N2O2/c1-14(7-10(11,12)13)6-9(17)15-4-2-8(16)3-5-15/h8,16H,2-7H2,1H3
InChIKeyLPOHMRTZEAQQGR-UHFFFAOYSA-N
XLogP0.46
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.25
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(4-hydroxypiperidin-1-yl)-2-[methyl(2,2,2-trifluoroethyl)amino]ethanone?
The IUPAC name of 1-(4-hydroxypiperidin-1-yl)-2-[methyl(2,2,2-trifluoroethyl)amino]ethanone (CID 71973080) is 1-(4-hydroxypiperidin-1-yl)-2-[methyl(2,2,2-trifluoroethyl)amino]ethanone.
What is the SMILES notation for 1-(4-hydroxypiperidin-1-yl)-2-[methyl(2,2,2-trifluoroethyl)amino]ethanone?
The canonical SMILES for 1-(4-hydroxypiperidin-1-yl)-2-[methyl(2,2,2-trifluoroethyl)amino]ethanone is CN(CC(=O)N1CCC(O)CC1)CC(F)(F)F.
What is the InChIKey of 1-(4-hydroxypiperidin-1-yl)-2-[methyl(2,2,2-trifluoroethyl)amino]ethanone?
The InChIKey is LPOHMRTZEAQQGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F3N2O2/c1-14(7-10(11,12)13)6-9(17)15-4-2-8(16)3-5-15/h8,16H,2-7H2,1H3.
What are the key properties of 1-(4-hydroxypiperidin-1-yl)-2-[methyl(2,2,2-trifluoroethyl)amino]ethanone?
1-(4-hydroxypiperidin-1-yl)-2-[methyl(2,2,2-trifluoroethyl)amino]ethanone has a molecular weight of 254.25 g/mol, XLogP of 0.46, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-hydroxypiperidin-1-yl)-2-[methyl(2,2,2-trifluoroethyl)amino]ethanone is sourced from PubChem (CID 71973080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).