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

C7H11F3N2O — CID 10774253

IUPAC2,2,2-trifluoro-N-piperidin-4-ylacetamide
SMILESO=C(NC1CCNCC1)C(F)(F)F
InChIInChI=1S/C7H11F3N2O/c8-7(9,10)6(13)12-5-1-3-11-4-2-5/h5,11H,1-4H2,(H,12,13)
InChIKeySVIRKOCSSOKHBX-UHFFFAOYSA-N
MW196.17 g/mol
LogP0.42
Rot. Bonds1

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

2,2,2-trifluoro-N-piperidin-4-ylacetamide (PubChem CID 10774253) has the molecular formula C7H11F3N2O and a molecular weight of 196.17 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-piperidin-4-ylacetamide.

Molecular Properties

Compound Name2,2,2-trifluoro-N-piperidin-4-ylacetamide
PubChem CID10774253
Molecular FormulaC7H11F3N2O
Molecular Weight196.17 g/mol
Exact Mass196.08
IUPAC Name2,2,2-trifluoro-N-piperidin-4-ylacetamide
SMILESO=C(NC1CCNCC1)C(F)(F)F
InChIInChI=1S/C7H11F3N2O/c8-7(9,10)6(13)12-5-1-3-11-4-2-5/h5,11H,1-4H2,(H,12,13)
InChIKeySVIRKOCSSOKHBX-UHFFFAOYSA-N
XLogP0.42
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.17
LogP ≤ 50.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N-piperidin-4-ylacetamide?
The IUPAC name of 2,2,2-trifluoro-N-piperidin-4-ylacetamide (CID 10774253) is 2,2,2-trifluoro-N-piperidin-4-ylacetamide.
What is the SMILES notation for 2,2,2-trifluoro-N-piperidin-4-ylacetamide?
The canonical SMILES for 2,2,2-trifluoro-N-piperidin-4-ylacetamide is O=C(NC1CCNCC1)C(F)(F)F.
What is the InChIKey of 2,2,2-trifluoro-N-piperidin-4-ylacetamide?
The InChIKey is SVIRKOCSSOKHBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11F3N2O/c8-7(9,10)6(13)12-5-1-3-11-4-2-5/h5,11H,1-4H2,(H,12,13).
What are the key properties of 2,2,2-trifluoro-N-piperidin-4-ylacetamide?
2,2,2-trifluoro-N-piperidin-4-ylacetamide has a molecular weight of 196.17 g/mol, XLogP of 0.42, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-N-piperidin-4-ylacetamide is sourced from PubChem (CID 10774253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).