2-(2-amino-2-methylpropyl)sulfonyl-N-(2,2,2-trifluoroethyl)acetamide

C8H15F3N2O3S — CID 81188798

IUPAC2-(2-amino-2-methylpropyl)sulfonyl-N-(2,2,2-trifluoroethyl)acetamide
SMILESCC(C)(N)CS(=O)(=O)CC(=O)NCC(F)(F)F
InChIInChI=1S/C8H15F3N2O3S/c1-7(2,12)5-17(15,16)3-6(14)13-4-8(9,10)11/h3-5,12H2,1-2H3,(H,13,14)
InChIKeyUQDAIAKZBJFQBE-UHFFFAOYSA-N
MW276.28 g/mol
LogP-0.18
Rot. Bonds5

About 2-(2-amino-2-methylpropyl)sulfonyl-N-(2,2,2-trifluoroethyl)acetamide

2-(2-amino-2-methylpropyl)sulfonyl-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 81188798) has the molecular formula C8H15F3N2O3S and a molecular weight of 276.28 g/mol. Its IUPAC name is 2-(2-amino-2-methylpropyl)sulfonyl-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound Name2-(2-amino-2-methylpropyl)sulfonyl-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID81188798
Molecular FormulaC8H15F3N2O3S
Molecular Weight276.28 g/mol
Exact Mass276.08
IUPAC Name2-(2-amino-2-methylpropyl)sulfonyl-N-(2,2,2-trifluoroethyl)acetamide
SMILESCC(C)(N)CS(=O)(=O)CC(=O)NCC(F)(F)F
InChIInChI=1S/C8H15F3N2O3S/c1-7(2,12)5-17(15,16)3-6(14)13-4-8(9,10)11/h3-5,12H2,1-2H3,(H,13,14)
InChIKeyUQDAIAKZBJFQBE-UHFFFAOYSA-N
XLogP-0.18
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.28
LogP ≤ 5-0.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-2-methylpropyl)sulfonyl-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of 2-(2-amino-2-methylpropyl)sulfonyl-N-(2,2,2-trifluoroethyl)acetamide (CID 81188798) is 2-(2-amino-2-methylpropyl)sulfonyl-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for 2-(2-amino-2-methylpropyl)sulfonyl-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for 2-(2-amino-2-methylpropyl)sulfonyl-N-(2,2,2-trifluoroethyl)acetamide is CC(C)(N)CS(=O)(=O)CC(=O)NCC(F)(F)F.
What is the InChIKey of 2-(2-amino-2-methylpropyl)sulfonyl-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is UQDAIAKZBJFQBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15F3N2O3S/c1-7(2,12)5-17(15,16)3-6(14)13-4-8(9,10)11/h3-5,12H2,1-2H3,(H,13,14).
What are the key properties of 2-(2-amino-2-methylpropyl)sulfonyl-N-(2,2,2-trifluoroethyl)acetamide?
2-(2-amino-2-methylpropyl)sulfonyl-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 276.28 g/mol, XLogP of -0.18, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-2-methylpropyl)sulfonyl-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 81188798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).