4,4,4-trifluoro-N-(3-hydroxy-1-methylpiperidin-4-yl)butanamide

C10H17F3N2O2 — CID 134435532

IUPAC4,4,4-trifluoro-N-(3-hydroxy-1-methylpiperidin-4-yl)butanamide
SMILESCN1CCC(NC(=O)CCC(F)(F)F)C(O)C1
InChIInChI=1S/C10H17F3N2O2/c1-15-5-3-7(8(16)6-15)14-9(17)2-4-10(11,12)13/h7-8,16H,2-6H2,1H3,(H,14,17)
InChIKeyXGZOHLJPJKTJGB-UHFFFAOYSA-N
MW254.25 g/mol
LogP0.51
Rot. Bonds3

About 4,4,4-trifluoro-N-(3-hydroxy-1-methylpiperidin-4-yl)butanamide

4,4,4-trifluoro-N-(3-hydroxy-1-methylpiperidin-4-yl)butanamide (PubChem CID 134435532) has the molecular formula C10H17F3N2O2 and a molecular weight of 254.25 g/mol. Its IUPAC name is 4,4,4-trifluoro-N-(3-hydroxy-1-methylpiperidin-4-yl)butanamide.

Molecular Properties

Compound Name4,4,4-trifluoro-N-(3-hydroxy-1-methylpiperidin-4-yl)butanamide
PubChem CID134435532
Molecular FormulaC10H17F3N2O2
Molecular Weight254.25 g/mol
Exact Mass254.12
IUPAC Name4,4,4-trifluoro-N-(3-hydroxy-1-methylpiperidin-4-yl)butanamide
SMILESCN1CCC(NC(=O)CCC(F)(F)F)C(O)C1
InChIInChI=1S/C10H17F3N2O2/c1-15-5-3-7(8(16)6-15)14-9(17)2-4-10(11,12)13/h7-8,16H,2-6H2,1H3,(H,14,17)
InChIKeyXGZOHLJPJKTJGB-UHFFFAOYSA-N
XLogP0.51
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.25
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4,4,4-trifluoro-N-(3-hydroxy-1-methylpiperidin-4-yl)butanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4,4,4-trifluoro-N-(3-hydroxy-1-methylpiperidin-4-yl)butanamide?
The IUPAC name of 4,4,4-trifluoro-N-(3-hydroxy-1-methylpiperidin-4-yl)butanamide (CID 134435532) is 4,4,4-trifluoro-N-(3-hydroxy-1-methylpiperidin-4-yl)butanamide.
What is the SMILES notation for 4,4,4-trifluoro-N-(3-hydroxy-1-methylpiperidin-4-yl)butanamide?
The canonical SMILES for 4,4,4-trifluoro-N-(3-hydroxy-1-methylpiperidin-4-yl)butanamide is CN1CCC(NC(=O)CCC(F)(F)F)C(O)C1.
What is the InChIKey of 4,4,4-trifluoro-N-(3-hydroxy-1-methylpiperidin-4-yl)butanamide?
The InChIKey is XGZOHLJPJKTJGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F3N2O2/c1-15-5-3-7(8(16)6-15)14-9(17)2-4-10(11,12)13/h7-8,16H,2-6H2,1H3,(H,14,17).
What are the key properties of 4,4,4-trifluoro-N-(3-hydroxy-1-methylpiperidin-4-yl)butanamide?
4,4,4-trifluoro-N-(3-hydroxy-1-methylpiperidin-4-yl)butanamide has a molecular weight of 254.25 g/mol, XLogP of 0.51, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4,4-trifluoro-N-(3-hydroxy-1-methylpiperidin-4-yl)butanamide is sourced from PubChem (CID 134435532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).