2,2,2-trifluoro-N-[2-methyl-4-[(2-methylpropan-2-yl)oxy]butan-2-yl]acetamide

C11H20F3NO2 — CID 88578165

IUPAC2,2,2-trifluoro-N-[2-methyl-4-[(2-methylpropan-2-yl)oxy]butan-2-yl]acetamide
SMILESCC(C)(CCOC(C)(C)C)NC(=O)C(F)(F)F
InChIInChI=1S/C11H20F3NO2/c1-9(2,3)17-7-6-10(4,5)15-8(16)11(12,13)14/h6-7H2,1-5H3,(H,15,16)
InChIKeyZEUHHFPMSUUQMG-UHFFFAOYSA-N
MW255.28 g/mol
LogP2.65
Rot. Bonds4

About 2,2,2-trifluoro-N-[2-methyl-4-[(2-methylpropan-2-yl)oxy]butan-2-yl]acetamide

2,2,2-trifluoro-N-[2-methyl-4-[(2-methylpropan-2-yl)oxy]butan-2-yl]acetamide (PubChem CID 88578165) has the molecular formula C11H20F3NO2 and a molecular weight of 255.28 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-[2-methyl-4-[(2-methylpropan-2-yl)oxy]butan-2-yl]acetamide.

Molecular Properties

Compound Name2,2,2-trifluoro-N-[2-methyl-4-[(2-methylpropan-2-yl)oxy]butan-2-yl]acetamide
PubChem CID88578165
Molecular FormulaC11H20F3NO2
Molecular Weight255.28 g/mol
Exact Mass255.14
IUPAC Name2,2,2-trifluoro-N-[2-methyl-4-[(2-methylpropan-2-yl)oxy]butan-2-yl]acetamide
SMILESCC(C)(CCOC(C)(C)C)NC(=O)C(F)(F)F
InChIInChI=1S/C11H20F3NO2/c1-9(2,3)17-7-6-10(4,5)15-8(16)11(12,13)14/h6-7H2,1-5H3,(H,15,16)
InChIKeyZEUHHFPMSUUQMG-UHFFFAOYSA-N
XLogP2.65
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.28
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N-[2-methyl-4-[(2-methylpropan-2-yl)oxy]butan-2-yl]acetamide?
The IUPAC name of 2,2,2-trifluoro-N-[2-methyl-4-[(2-methylpropan-2-yl)oxy]butan-2-yl]acetamide (CID 88578165) is 2,2,2-trifluoro-N-[2-methyl-4-[(2-methylpropan-2-yl)oxy]butan-2-yl]acetamide.
What is the SMILES notation for 2,2,2-trifluoro-N-[2-methyl-4-[(2-methylpropan-2-yl)oxy]butan-2-yl]acetamide?
The canonical SMILES for 2,2,2-trifluoro-N-[2-methyl-4-[(2-methylpropan-2-yl)oxy]butan-2-yl]acetamide is CC(C)(CCOC(C)(C)C)NC(=O)C(F)(F)F.
What is the InChIKey of 2,2,2-trifluoro-N-[2-methyl-4-[(2-methylpropan-2-yl)oxy]butan-2-yl]acetamide?
The InChIKey is ZEUHHFPMSUUQMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20F3NO2/c1-9(2,3)17-7-6-10(4,5)15-8(16)11(12,13)14/h6-7H2,1-5H3,(H,15,16).
What are the key properties of 2,2,2-trifluoro-N-[2-methyl-4-[(2-methylpropan-2-yl)oxy]butan-2-yl]acetamide?
2,2,2-trifluoro-N-[2-methyl-4-[(2-methylpropan-2-yl)oxy]butan-2-yl]acetamide has a molecular weight of 255.28 g/mol, XLogP of 2.65, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-N-[2-methyl-4-[(2-methylpropan-2-yl)oxy]butan-2-yl]acetamide is sourced from PubChem (CID 88578165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).