2,2-dimethyl-1-[propan-2-yl(sulfamoyl)amino]propane

C8H20N2O2S — CID 58780672

IUPAC2,2-dimethyl-1-[propan-2-yl(sulfamoyl)amino]propane
SMILESCC(C)N(CC(C)(C)C)S(N)(=O)=O
InChIInChI=1S/C8H20N2O2S/c1-7(2)10(13(9,11)12)6-8(3,4)5/h7H,6H2,1-5H3,(H2,9,11,12)
InChIKeyBVPSJOJZCNDVLF-UHFFFAOYSA-N
MW208.33 g/mol
LogP0.95
Rot. Bonds3

About 2,2-dimethyl-1-[propan-2-yl(sulfamoyl)amino]propane

2,2-dimethyl-1-[propan-2-yl(sulfamoyl)amino]propane (PubChem CID 58780672) has the molecular formula C8H20N2O2S and a molecular weight of 208.33 g/mol. Its IUPAC name is 2,2-dimethyl-1-[propan-2-yl(sulfamoyl)amino]propane.

Molecular Properties

Compound Name2,2-dimethyl-1-[propan-2-yl(sulfamoyl)amino]propane
PubChem CID58780672
Molecular FormulaC8H20N2O2S
Molecular Weight208.33 g/mol
Exact Mass208.12
IUPAC Name2,2-dimethyl-1-[propan-2-yl(sulfamoyl)amino]propane
SMILESCC(C)N(CC(C)(C)C)S(N)(=O)=O
InChIInChI=1S/C8H20N2O2S/c1-7(2)10(13(9,11)12)6-8(3,4)5/h7H,6H2,1-5H3,(H2,9,11,12)
InChIKeyBVPSJOJZCNDVLF-UHFFFAOYSA-N
XLogP0.95
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.33
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-1-[propan-2-yl(sulfamoyl)amino]propane?
The IUPAC name of 2,2-dimethyl-1-[propan-2-yl(sulfamoyl)amino]propane (CID 58780672) is 2,2-dimethyl-1-[propan-2-yl(sulfamoyl)amino]propane.
What is the SMILES notation for 2,2-dimethyl-1-[propan-2-yl(sulfamoyl)amino]propane?
The canonical SMILES for 2,2-dimethyl-1-[propan-2-yl(sulfamoyl)amino]propane is CC(C)N(CC(C)(C)C)S(N)(=O)=O.
What is the InChIKey of 2,2-dimethyl-1-[propan-2-yl(sulfamoyl)amino]propane?
The InChIKey is BVPSJOJZCNDVLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20N2O2S/c1-7(2)10(13(9,11)12)6-8(3,4)5/h7H,6H2,1-5H3,(H2,9,11,12).
What are the key properties of 2,2-dimethyl-1-[propan-2-yl(sulfamoyl)amino]propane?
2,2-dimethyl-1-[propan-2-yl(sulfamoyl)amino]propane has a molecular weight of 208.33 g/mol, XLogP of 0.95, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-1-[propan-2-yl(sulfamoyl)amino]propane is sourced from PubChem (CID 58780672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).