2-piperidin-4-yloxy-N-[2-(2,2,2-trifluoroethoxy)ethyl]acetamide

C11H19F3N2O3 — CID 55251946

IUPAC2-piperidin-4-yloxy-N-[2-(2,2,2-trifluoroethoxy)ethyl]acetamide
SMILESO=C(COC1CCNCC1)NCCOCC(F)(F)F
InChIInChI=1S/C11H19F3N2O3/c12-11(13,14)8-18-6-5-16-10(17)7-19-9-1-3-15-4-2-9/h9,15H,1-8H2,(H,16,17)
InChIKeyAJRTZDYQZWJFBJ-UHFFFAOYSA-N
MW284.28 g/mol
LogP0.45
Rot. Bonds7

About 2-piperidin-4-yloxy-N-[2-(2,2,2-trifluoroethoxy)ethyl]acetamide

2-piperidin-4-yloxy-N-[2-(2,2,2-trifluoroethoxy)ethyl]acetamide (PubChem CID 55251946) has the molecular formula C11H19F3N2O3 and a molecular weight of 284.28 g/mol. Its IUPAC name is 2-piperidin-4-yloxy-N-[2-(2,2,2-trifluoroethoxy)ethyl]acetamide.

Molecular Properties

Compound Name2-piperidin-4-yloxy-N-[2-(2,2,2-trifluoroethoxy)ethyl]acetamide
PubChem CID55251946
Molecular FormulaC11H19F3N2O3
Molecular Weight284.28 g/mol
Exact Mass284.13
IUPAC Name2-piperidin-4-yloxy-N-[2-(2,2,2-trifluoroethoxy)ethyl]acetamide
SMILESO=C(COC1CCNCC1)NCCOCC(F)(F)F
InChIInChI=1S/C11H19F3N2O3/c12-11(13,14)8-18-6-5-16-10(17)7-19-9-1-3-15-4-2-9/h9,15H,1-8H2,(H,16,17)
InChIKeyAJRTZDYQZWJFBJ-UHFFFAOYSA-N
XLogP0.45
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.28
LogP ≤ 50.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-piperidin-4-yloxy-N-[2-(2,2,2-trifluoroethoxy)ethyl]acetamide?
The IUPAC name of 2-piperidin-4-yloxy-N-[2-(2,2,2-trifluoroethoxy)ethyl]acetamide (CID 55251946) is 2-piperidin-4-yloxy-N-[2-(2,2,2-trifluoroethoxy)ethyl]acetamide.
What is the SMILES notation for 2-piperidin-4-yloxy-N-[2-(2,2,2-trifluoroethoxy)ethyl]acetamide?
The canonical SMILES for 2-piperidin-4-yloxy-N-[2-(2,2,2-trifluoroethoxy)ethyl]acetamide is O=C(COC1CCNCC1)NCCOCC(F)(F)F.
What is the InChIKey of 2-piperidin-4-yloxy-N-[2-(2,2,2-trifluoroethoxy)ethyl]acetamide?
The InChIKey is AJRTZDYQZWJFBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19F3N2O3/c12-11(13,14)8-18-6-5-16-10(17)7-19-9-1-3-15-4-2-9/h9,15H,1-8H2,(H,16,17).
What are the key properties of 2-piperidin-4-yloxy-N-[2-(2,2,2-trifluoroethoxy)ethyl]acetamide?
2-piperidin-4-yloxy-N-[2-(2,2,2-trifluoroethoxy)ethyl]acetamide has a molecular weight of 284.28 g/mol, XLogP of 0.45, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperidin-4-yloxy-N-[2-(2,2,2-trifluoroethoxy)ethyl]acetamide is sourced from PubChem (CID 55251946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).