1-[tert-butylsulfamoyl(methyl)amino]-2-methylpropane

C9H22N2O2S — CID 20673452

IUPAC1-[tert-butylsulfamoyl(methyl)amino]-2-methylpropane
SMILESCC(C)CN(C)S(=O)(=O)NC(C)(C)C
InChIInChI=1S/C9H22N2O2S/c1-8(2)7-11(6)14(12,13)10-9(3,4)5/h8,10H,7H2,1-6H3
InChIKeyVVTKUPSPSLZGEP-UHFFFAOYSA-N
MW222.35 g/mol
LogP1.21
Rot. Bonds4

About 1-[tert-butylsulfamoyl(methyl)amino]-2-methylpropane

1-[tert-butylsulfamoyl(methyl)amino]-2-methylpropane (PubChem CID 20673452) has the molecular formula C9H22N2O2S and a molecular weight of 222.35 g/mol. Its IUPAC name is 1-[tert-butylsulfamoyl(methyl)amino]-2-methylpropane.

Molecular Properties

Compound Name1-[tert-butylsulfamoyl(methyl)amino]-2-methylpropane
PubChem CID20673452
Molecular FormulaC9H22N2O2S
Molecular Weight222.35 g/mol
Exact Mass222.14
IUPAC Name1-[tert-butylsulfamoyl(methyl)amino]-2-methylpropane
SMILESCC(C)CN(C)S(=O)(=O)NC(C)(C)C
InChIInChI=1S/C9H22N2O2S/c1-8(2)7-11(6)14(12,13)10-9(3,4)5/h8,10H,7H2,1-6H3
InChIKeyVVTKUPSPSLZGEP-UHFFFAOYSA-N
XLogP1.21
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.35
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[tert-butylsulfamoyl(methyl)amino]-2-methylpropane?
The IUPAC name of 1-[tert-butylsulfamoyl(methyl)amino]-2-methylpropane (CID 20673452) is 1-[tert-butylsulfamoyl(methyl)amino]-2-methylpropane.
What is the SMILES notation for 1-[tert-butylsulfamoyl(methyl)amino]-2-methylpropane?
The canonical SMILES for 1-[tert-butylsulfamoyl(methyl)amino]-2-methylpropane is CC(C)CN(C)S(=O)(=O)NC(C)(C)C.
What is the InChIKey of 1-[tert-butylsulfamoyl(methyl)amino]-2-methylpropane?
The InChIKey is VVTKUPSPSLZGEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H22N2O2S/c1-8(2)7-11(6)14(12,13)10-9(3,4)5/h8,10H,7H2,1-6H3.
What are the key properties of 1-[tert-butylsulfamoyl(methyl)amino]-2-methylpropane?
1-[tert-butylsulfamoyl(methyl)amino]-2-methylpropane has a molecular weight of 222.35 g/mol, XLogP of 1.21, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[tert-butylsulfamoyl(methyl)amino]-2-methylpropane is sourced from PubChem (CID 20673452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).