2-methyl-1-(propan-2-ylsulfamoylamino)pentan-2-ol

C9H22N2O3S — CID 103946772

IUPAC2-methyl-1-(propan-2-ylsulfamoylamino)pentan-2-ol
SMILESCCCC(C)(O)CNS(=O)(=O)NC(C)C
InChIInChI=1S/C9H22N2O3S/c1-5-6-9(4,12)7-10-15(13,14)11-8(2)3/h8,10-12H,5-7H2,1-4H3
InChIKeyIYLZICOPLMHYEB-UHFFFAOYSA-N
MW238.35 g/mol
LogP0.37
Rot. Bonds7

About 2-methyl-1-(propan-2-ylsulfamoylamino)pentan-2-ol

2-methyl-1-(propan-2-ylsulfamoylamino)pentan-2-ol (PubChem CID 103946772) has the molecular formula C9H22N2O3S and a molecular weight of 238.35 g/mol. Its IUPAC name is 2-methyl-1-(propan-2-ylsulfamoylamino)pentan-2-ol.

Molecular Properties

Compound Name2-methyl-1-(propan-2-ylsulfamoylamino)pentan-2-ol
PubChem CID103946772
Molecular FormulaC9H22N2O3S
Molecular Weight238.35 g/mol
Exact Mass238.14
IUPAC Name2-methyl-1-(propan-2-ylsulfamoylamino)pentan-2-ol
SMILESCCCC(C)(O)CNS(=O)(=O)NC(C)C
InChIInChI=1S/C9H22N2O3S/c1-5-6-9(4,12)7-10-15(13,14)11-8(2)3/h8,10-12H,5-7H2,1-4H3
InChIKeyIYLZICOPLMHYEB-UHFFFAOYSA-N
XLogP0.37
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.35
LogP ≤ 50.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-Methyl-1-(2,2,2-trifluoroethylsulfamoylamino)pentan-2-ol
CID 106290432
3-Hydroxy-3-[[[methyl(propan-2-yl)sulfamoyl]amino]methyl]pentane
CID 65113148
1-(Dimethylsulfamoylamino)-2-hydroxy-2,4-dimethylpentane
CID 66178595
1-[[Butyl(methyl)sulfamoyl]amino]-2-hydroxy-2,4-dimethylpentane
CID 66178603
1-(Diethylsulfamoylamino)-2-hydroxy-2,4-dimethylpentane
CID 66179385
2-Hydroxy-2,4-dimethyl-1-[[methyl(propan-2-yl)sulfamoyl]amino]pentane
CID 66179782
1-(Ethylsulfamoylamino)-2-methylpentan-2-ol
CID 103835269
[(2-Hydroxy-2-methylpentyl)sulfamoyl-methylamino]cyclohexane
CID 103835331
2-Hydroxy-2-methyl-1-[[methyl(propan-2-yl)sulfamoyl]amino]pentane
CID 103835333
1-(Dimethylsulfamoylamino)-2-hydroxy-2-methylpentane
CID 103835334
1-(Diethylsulfamoylamino)-2-hydroxy-2-methylpentane
CID 103835349
4-Methyl-1-(propan-2-ylsulfamoylamino)pentan-2-ol
CID 103946765

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(propan-2-ylsulfamoylamino)pentan-2-ol?
The IUPAC name of 2-methyl-1-(propan-2-ylsulfamoylamino)pentan-2-ol (CID 103946772) is 2-methyl-1-(propan-2-ylsulfamoylamino)pentan-2-ol.
What is the SMILES notation for 2-methyl-1-(propan-2-ylsulfamoylamino)pentan-2-ol?
The canonical SMILES for 2-methyl-1-(propan-2-ylsulfamoylamino)pentan-2-ol is CCCC(C)(O)CNS(=O)(=O)NC(C)C.
What is the InChIKey of 2-methyl-1-(propan-2-ylsulfamoylamino)pentan-2-ol?
The InChIKey is IYLZICOPLMHYEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H22N2O3S/c1-5-6-9(4,12)7-10-15(13,14)11-8(2)3/h8,10-12H,5-7H2,1-4H3.
What are the key properties of 2-methyl-1-(propan-2-ylsulfamoylamino)pentan-2-ol?
2-methyl-1-(propan-2-ylsulfamoylamino)pentan-2-ol has a molecular weight of 238.35 g/mol, XLogP of 0.37, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(propan-2-ylsulfamoylamino)pentan-2-ol is sourced from PubChem (CID 103946772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).