N-ethyl-2,2,2-trifluoro-N-piperidin-4-ylacetamide

C9H15F3N2O — CID 19421916

IUPACN-ethyl-2,2,2-trifluoro-N-piperidin-4-ylacetamide
SMILESCCN(C(=O)C(F)(F)F)C1CCNCC1
InChIInChI=1S/C9H15F3N2O/c1-2-14(8(15)9(10,11)12)7-3-5-13-6-4-7/h7,13H,2-6H2,1H3
InChIKeyNZWKZPUEXGMMRG-UHFFFAOYSA-N
MW224.23 g/mol
LogP1.15
Rot. Bonds2

About N-ethyl-2,2,2-trifluoro-N-piperidin-4-ylacetamide

N-ethyl-2,2,2-trifluoro-N-piperidin-4-ylacetamide (PubChem CID 19421916) has the molecular formula C9H15F3N2O and a molecular weight of 224.23 g/mol. Its IUPAC name is N-ethyl-2,2,2-trifluoro-N-piperidin-4-ylacetamide.

Molecular Properties

Compound NameN-ethyl-2,2,2-trifluoro-N-piperidin-4-ylacetamide
PubChem CID19421916
Molecular FormulaC9H15F3N2O
Molecular Weight224.23 g/mol
Exact Mass224.11
IUPAC NameN-ethyl-2,2,2-trifluoro-N-piperidin-4-ylacetamide
SMILESCCN(C(=O)C(F)(F)F)C1CCNCC1
InChIInChI=1S/C9H15F3N2O/c1-2-14(8(15)9(10,11)12)7-3-5-13-6-4-7/h7,13H,2-6H2,1H3
InChIKeyNZWKZPUEXGMMRG-UHFFFAOYSA-N
XLogP1.15
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.23
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,2,2-trifluoro-N-piperidin-4-ylacetamide?
The IUPAC name of N-ethyl-2,2,2-trifluoro-N-piperidin-4-ylacetamide (CID 19421916) is N-ethyl-2,2,2-trifluoro-N-piperidin-4-ylacetamide.
What is the SMILES notation for N-ethyl-2,2,2-trifluoro-N-piperidin-4-ylacetamide?
The canonical SMILES for N-ethyl-2,2,2-trifluoro-N-piperidin-4-ylacetamide is CCN(C(=O)C(F)(F)F)C1CCNCC1.
What is the InChIKey of N-ethyl-2,2,2-trifluoro-N-piperidin-4-ylacetamide?
The InChIKey is NZWKZPUEXGMMRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15F3N2O/c1-2-14(8(15)9(10,11)12)7-3-5-13-6-4-7/h7,13H,2-6H2,1H3.
What are the key properties of N-ethyl-2,2,2-trifluoro-N-piperidin-4-ylacetamide?
N-ethyl-2,2,2-trifluoro-N-piperidin-4-ylacetamide has a molecular weight of 224.23 g/mol, XLogP of 1.15, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,2,2-trifluoro-N-piperidin-4-ylacetamide is sourced from PubChem (CID 19421916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).