2-hydroxy-2-methyl-1-[[methyl(propan-2-yl)sulfamoyl]amino]-3-methylsulfanylpropane

C9H22N2O3S2 — CID 103835642

IUPAC2-hydroxy-2-methyl-1-[[methyl(propan-2-yl)sulfamoyl]amino]-3-methylsulfanylpropane
SMILESCSCC(C)(O)CNS(=O)(=O)N(C)C(C)C
InChIInChI=1S/C9H22N2O3S2/c1-8(2)11(4)16(13,14)10-6-9(3,12)7-15-5/h8,10,12H,6-7H2,1-5H3
InChIKeyHTCZIRPYHNTWBO-UHFFFAOYSA-N
MW270.42 g/mol
LogP0.28
Rot. Bonds7

About 2-hydroxy-2-methyl-1-[[methyl(propan-2-yl)sulfamoyl]amino]-3-methylsulfanylpropane

2-hydroxy-2-methyl-1-[[methyl(propan-2-yl)sulfamoyl]amino]-3-methylsulfanylpropane (PubChem CID 103835642) has the molecular formula C9H22N2O3S2 and a molecular weight of 270.42 g/mol. Its IUPAC name is 2-hydroxy-2-methyl-1-[[methyl(propan-2-yl)sulfamoyl]amino]-3-methylsulfanylpropane.

Molecular Properties

Compound Name2-hydroxy-2-methyl-1-[[methyl(propan-2-yl)sulfamoyl]amino]-3-methylsulfanylpropane
PubChem CID103835642
Molecular FormulaC9H22N2O3S2
Molecular Weight270.42 g/mol
Exact Mass270.11
IUPAC Name2-hydroxy-2-methyl-1-[[methyl(propan-2-yl)sulfamoyl]amino]-3-methylsulfanylpropane
SMILESCSCC(C)(O)CNS(=O)(=O)N(C)C(C)C
InChIInChI=1S/C9H22N2O3S2/c1-8(2)11(4)16(13,14)10-6-9(3,12)7-15-5/h8,10,12H,6-7H2,1-5H3
InChIKeyHTCZIRPYHNTWBO-UHFFFAOYSA-N
XLogP0.28
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 50.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(Dipropylsulfamoylamino)-2-hydroxy-2-methyl-3-methylsulfanylpropane
CID 103835595
1-(Ethylsulfamoylamino)-2-methyl-3-methylsulfanylpropan-2-ol
CID 103835598
[(2-Hydroxy-2-methyl-3-methylsulfanylpropyl)sulfamoyl-methylamino]cyclohexane
CID 103835640
1-(Dimethylsulfamoylamino)-2-hydroxy-2-methyl-3-methylsulfanylpropane
CID 103835643
1-(Diethylsulfamoylamino)-2-hydroxy-2-methyl-3-methylsulfanylpropane
CID 103835651
1-[[Butyl(methyl)sulfamoyl]amino]-2-hydroxy-2-methyl-3-methylsulfanylpropane
CID 103835696
2-Methyl-1-methylsulfanyl-3-(propan-2-ylsulfamoylamino)propan-2-ol
CID 103946774
1-(Cyclopropylsulfamoylamino)-2-methyl-3-methylsulfanylpropan-2-ol
CID 104919165
2-Methyl-1-methylsulfanyl-3-(propylsulfamoylamino)propan-2-ol
CID 106245444
2-Methyl-1-(2-methylpropylsulfamoylamino)-3-methylsulfanylpropan-2-ol
CID 106245568
1-(Tert-butylsulfamoylamino)-2-methyl-3-methylsulfanylpropan-2-ol
CID 106245603
2-Methyl-1-(methylsulfamoylamino)-3-methylsulfanylpropan-2-ol
CID 106245606

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-2-methyl-1-[[methyl(propan-2-yl)sulfamoyl]amino]-3-methylsulfanylpropane?
The IUPAC name of 2-hydroxy-2-methyl-1-[[methyl(propan-2-yl)sulfamoyl]amino]-3-methylsulfanylpropane (CID 103835642) is 2-hydroxy-2-methyl-1-[[methyl(propan-2-yl)sulfamoyl]amino]-3-methylsulfanylpropane.
What is the SMILES notation for 2-hydroxy-2-methyl-1-[[methyl(propan-2-yl)sulfamoyl]amino]-3-methylsulfanylpropane?
The canonical SMILES for 2-hydroxy-2-methyl-1-[[methyl(propan-2-yl)sulfamoyl]amino]-3-methylsulfanylpropane is CSCC(C)(O)CNS(=O)(=O)N(C)C(C)C.
What is the InChIKey of 2-hydroxy-2-methyl-1-[[methyl(propan-2-yl)sulfamoyl]amino]-3-methylsulfanylpropane?
The InChIKey is HTCZIRPYHNTWBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H22N2O3S2/c1-8(2)11(4)16(13,14)10-6-9(3,12)7-15-5/h8,10,12H,6-7H2,1-5H3.
What are the key properties of 2-hydroxy-2-methyl-1-[[methyl(propan-2-yl)sulfamoyl]amino]-3-methylsulfanylpropane?
2-hydroxy-2-methyl-1-[[methyl(propan-2-yl)sulfamoyl]amino]-3-methylsulfanylpropane has a molecular weight of 270.42 g/mol, XLogP of 0.28, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-2-methyl-1-[[methyl(propan-2-yl)sulfamoyl]amino]-3-methylsulfanylpropane is sourced from PubChem (CID 103835642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).