2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide

C11H19F3N2O2 — CID 62355949

IUPAC2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
SMILESO=C(CN1CCCC(CCO)C1)NCC(F)(F)F
InChIInChI=1S/C11H19F3N2O2/c12-11(13,14)8-15-10(18)7-16-4-1-2-9(6-16)3-5-17/h9,17H,1-8H2,(H,15,18)
InChIKeyRRHPVMDFZLNGQM-UHFFFAOYSA-N
MW268.28 g/mol
LogP0.76
Rot. Bonds5

About 2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide

2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 62355949) has the molecular formula C11H19F3N2O2 and a molecular weight of 268.28 g/mol. Its IUPAC name is 2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound Name2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID62355949
Molecular FormulaC11H19F3N2O2
Molecular Weight268.28 g/mol
Exact Mass268.14
IUPAC Name2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
SMILESO=C(CN1CCCC(CCO)C1)NCC(F)(F)F
InChIInChI=1S/C11H19F3N2O2/c12-11(13,14)8-15-10(18)7-16-4-1-2-9(6-16)3-5-17/h9,17H,1-8H2,(H,15,18)
InChIKeyRRHPVMDFZLNGQM-UHFFFAOYSA-N
XLogP0.76
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.28
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of 2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide (CID 62355949) is 2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for 2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for 2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide is O=C(CN1CCCC(CCO)C1)NCC(F)(F)F.
What is the InChIKey of 2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is RRHPVMDFZLNGQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19F3N2O2/c12-11(13,14)8-15-10(18)7-16-4-1-2-9(6-16)3-5-17/h9,17H,1-8H2,(H,15,18).
What are the key properties of 2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide?
2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 268.28 g/mol, XLogP of 0.76, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 62355949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).