2-fluoro-2-methyl-4-[methyl(methylsulfamoyl)amino]pentane

C8H19FN2O2S — CID 155929244

IUPAC2-fluoro-2-methyl-4-[methyl(methylsulfamoyl)amino]pentane
SMILESCNS(=O)(=O)N(C)C(C)CC(C)(C)F
InChIInChI=1S/C8H19FN2O2S/c1-7(6-8(2,3)9)11(5)14(12,13)10-4/h7,10H,6H2,1-5H3
InChIKeyMAZIIKOWHIJKEH-UHFFFAOYSA-N
MW226.32 g/mol
LogP0.91
Rot. Bonds5

About 2-fluoro-2-methyl-4-[methyl(methylsulfamoyl)amino]pentane

2-fluoro-2-methyl-4-[methyl(methylsulfamoyl)amino]pentane (PubChem CID 155929244) has the molecular formula C8H19FN2O2S and a molecular weight of 226.32 g/mol. Its IUPAC name is 2-fluoro-2-methyl-4-[methyl(methylsulfamoyl)amino]pentane.

Molecular Properties

Compound Name2-fluoro-2-methyl-4-[methyl(methylsulfamoyl)amino]pentane
PubChem CID155929244
Molecular FormulaC8H19FN2O2S
Molecular Weight226.32 g/mol
Exact Mass226.12
IUPAC Name2-fluoro-2-methyl-4-[methyl(methylsulfamoyl)amino]pentane
SMILESCNS(=O)(=O)N(C)C(C)CC(C)(C)F
InChIInChI=1S/C8H19FN2O2S/c1-7(6-8(2,3)9)11(5)14(12,13)10-4/h7,10H,6H2,1-5H3
InChIKeyMAZIIKOWHIJKEH-UHFFFAOYSA-N
XLogP0.91
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-2-methyl-4-[methyl(methylsulfamoyl)amino]pentane?
The IUPAC name of 2-fluoro-2-methyl-4-[methyl(methylsulfamoyl)amino]pentane (CID 155929244) is 2-fluoro-2-methyl-4-[methyl(methylsulfamoyl)amino]pentane.
What is the SMILES notation for 2-fluoro-2-methyl-4-[methyl(methylsulfamoyl)amino]pentane?
The canonical SMILES for 2-fluoro-2-methyl-4-[methyl(methylsulfamoyl)amino]pentane is CNS(=O)(=O)N(C)C(C)CC(C)(C)F.
What is the InChIKey of 2-fluoro-2-methyl-4-[methyl(methylsulfamoyl)amino]pentane?
The InChIKey is MAZIIKOWHIJKEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19FN2O2S/c1-7(6-8(2,3)9)11(5)14(12,13)10-4/h7,10H,6H2,1-5H3.
What are the key properties of 2-fluoro-2-methyl-4-[methyl(methylsulfamoyl)amino]pentane?
2-fluoro-2-methyl-4-[methyl(methylsulfamoyl)amino]pentane has a molecular weight of 226.32 g/mol, XLogP of 0.91, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-2-methyl-4-[methyl(methylsulfamoyl)amino]pentane is sourced from PubChem (CID 155929244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).