1-[dipropylsulfamoyl(ethyl)amino]-2-methylpropan-2-ol

C12H28N2O3S — CID 79387707

IUPAC1-[dipropylsulfamoyl(ethyl)amino]-2-methylpropan-2-ol
SMILESCCCN(CCC)S(=O)(=O)N(CC)CC(C)(C)O
InChIInChI=1S/C12H28N2O3S/c1-6-9-14(10-7-2)18(16,17)13(8-3)11-12(4,5)15/h15H,6-11H2,1-5H3
InChIKeyWORVWEURVLZPQD-UHFFFAOYSA-N
MW280.43 g/mol
LogP1.45
Rot. Bonds9

About 1-[dipropylsulfamoyl(ethyl)amino]-2-methylpropan-2-ol

1-[dipropylsulfamoyl(ethyl)amino]-2-methylpropan-2-ol (PubChem CID 79387707) has the molecular formula C12H28N2O3S and a molecular weight of 280.43 g/mol. Its IUPAC name is 1-[dipropylsulfamoyl(ethyl)amino]-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-[dipropylsulfamoyl(ethyl)amino]-2-methylpropan-2-ol
PubChem CID79387707
Molecular FormulaC12H28N2O3S
Molecular Weight280.43 g/mol
Exact Mass280.18
IUPAC Name1-[dipropylsulfamoyl(ethyl)amino]-2-methylpropan-2-ol
SMILESCCCN(CCC)S(=O)(=O)N(CC)CC(C)(C)O
InChIInChI=1S/C12H28N2O3S/c1-6-9-14(10-7-2)18(16,17)13(8-3)11-12(4,5)15/h15H,6-11H2,1-5H3
InChIKeyWORVWEURVLZPQD-UHFFFAOYSA-N
XLogP1.45
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.43
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[dipropylsulfamoyl(ethyl)amino]-2-methylpropan-2-ol?
The IUPAC name of 1-[dipropylsulfamoyl(ethyl)amino]-2-methylpropan-2-ol (CID 79387707) is 1-[dipropylsulfamoyl(ethyl)amino]-2-methylpropan-2-ol.
What is the SMILES notation for 1-[dipropylsulfamoyl(ethyl)amino]-2-methylpropan-2-ol?
The canonical SMILES for 1-[dipropylsulfamoyl(ethyl)amino]-2-methylpropan-2-ol is CCCN(CCC)S(=O)(=O)N(CC)CC(C)(C)O.
What is the InChIKey of 1-[dipropylsulfamoyl(ethyl)amino]-2-methylpropan-2-ol?
The InChIKey is WORVWEURVLZPQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28N2O3S/c1-6-9-14(10-7-2)18(16,17)13(8-3)11-12(4,5)15/h15H,6-11H2,1-5H3.
What are the key properties of 1-[dipropylsulfamoyl(ethyl)amino]-2-methylpropan-2-ol?
1-[dipropylsulfamoyl(ethyl)amino]-2-methylpropan-2-ol has a molecular weight of 280.43 g/mol, XLogP of 1.45, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[dipropylsulfamoyl(ethyl)amino]-2-methylpropan-2-ol is sourced from PubChem (CID 79387707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).