2-ethoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide

C11H19F3N2O2 — CID 43603390

IUPAC2-ethoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide
SMILESCCOCC(=O)N(CC(F)(F)F)C1CCNCC1
InChIInChI=1S/C11H19F3N2O2/c1-2-18-7-10(17)16(8-11(12,13)14)9-3-5-15-6-4-9/h9,15H,2-8H2,1H3
InChIKeyMYQCVAZOTMLSQS-UHFFFAOYSA-N
MW268.28 g/mol
LogP1.17
Rot. Bonds5

About 2-ethoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide

2-ethoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 43603390) has the molecular formula C11H19F3N2O2 and a molecular weight of 268.28 g/mol. Its IUPAC name is 2-ethoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound Name2-ethoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID43603390
Molecular FormulaC11H19F3N2O2
Molecular Weight268.28 g/mol
Exact Mass268.14
IUPAC Name2-ethoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide
SMILESCCOCC(=O)N(CC(F)(F)F)C1CCNCC1
InChIInChI=1S/C11H19F3N2O2/c1-2-18-7-10(17)16(8-11(12,13)14)9-3-5-15-6-4-9/h9,15H,2-8H2,1H3
InChIKeyMYQCVAZOTMLSQS-UHFFFAOYSA-N
XLogP1.17
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.28
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of 2-ethoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide (CID 43603390) is 2-ethoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for 2-ethoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for 2-ethoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide is CCOCC(=O)N(CC(F)(F)F)C1CCNCC1.
What is the InChIKey of 2-ethoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is MYQCVAZOTMLSQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19F3N2O2/c1-2-18-7-10(17)16(8-11(12,13)14)9-3-5-15-6-4-9/h9,15H,2-8H2,1H3.
What are the key properties of 2-ethoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide?
2-ethoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 268.28 g/mol, XLogP of 1.17, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 43603390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).