2-methyl-1-(methylsulfamoylamino)pentan-2-ol

C7H18N2O3S — CID 106290478

IUPAC2-methyl-1-(methylsulfamoylamino)pentan-2-ol
SMILESCCCC(C)(O)CNS(=O)(=O)NC
InChIInChI=1S/C7H18N2O3S/c1-4-5-7(2,10)6-9-13(11,12)8-3/h8-10H,4-6H2,1-3H3
InChIKeyUEIOGTVICZJQLE-UHFFFAOYSA-N
MW210.30 g/mol
LogP-0.41
Rot. Bonds6

About 2-methyl-1-(methylsulfamoylamino)pentan-2-ol

2-methyl-1-(methylsulfamoylamino)pentan-2-ol (PubChem CID 106290478) has the molecular formula C7H18N2O3S and a molecular weight of 210.30 g/mol. Its IUPAC name is 2-methyl-1-(methylsulfamoylamino)pentan-2-ol.

Molecular Properties

Compound Name2-methyl-1-(methylsulfamoylamino)pentan-2-ol
PubChem CID106290478
Molecular FormulaC7H18N2O3S
Molecular Weight210.30 g/mol
Exact Mass210.10
IUPAC Name2-methyl-1-(methylsulfamoylamino)pentan-2-ol
SMILESCCCC(C)(O)CNS(=O)(=O)NC
InChIInChI=1S/C7H18N2O3S/c1-4-5-7(2,10)6-9-13(11,12)8-3/h8-10H,4-6H2,1-3H3
InChIKeyUEIOGTVICZJQLE-UHFFFAOYSA-N
XLogP-0.41
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.30
LogP ≤ 5-0.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

methyl N-[(2-hydroxy-2-methylpentyl)sulfamoyl]carbamate
CID 106290429
N-(2-hydroxy-2-methylpentyl)-2-methylsulfonylethanesulfonamide
CID 103835338
2-hydroxy-2-methyl-3-(methylsulfamoylamino)propanoic acid
CID 114806493
3-chloro-N-(2-hydroxy-2-methylpentyl)-2-methylpropane-1-sulfonamide
CID 106295329
2-methyl-1-(2-propan-2-ylsulfonylethylamino)pentan-2-ol
CID 106293022
4-amino-2-chloro-N-(2-hydroxy-2-methylpentyl)benzenesulfonamide
CID 106289599
2,2-dimethyl-N-(methylsulfamoyl)pentane-1,5-diamine
CID 106141802
N-(2-hydroxy-2-methylpentyl)-3-methylbenzenesulfonamide
CID 103835403
2-hydroxy-2,5-dimethyl-1-(sulfamoylamino)hexane
CID 111450153
N-(2-hydroxy-2-methylpentyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide
CID 106290415
5-amino-2-[(2-hydroxy-2-methylpentyl)amino]-N-methylbenzenesulfonamide
CID 106290279
4-amino-2-bromo-N-(2-hydroxy-2-methylpentyl)benzenesulfonamide
CID 106289563

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(methylsulfamoylamino)pentan-2-ol?
The IUPAC name of 2-methyl-1-(methylsulfamoylamino)pentan-2-ol (CID 106290478) is 2-methyl-1-(methylsulfamoylamino)pentan-2-ol.
What is the SMILES notation for 2-methyl-1-(methylsulfamoylamino)pentan-2-ol?
The canonical SMILES for 2-methyl-1-(methylsulfamoylamino)pentan-2-ol is CCCC(C)(O)CNS(=O)(=O)NC.
What is the InChIKey of 2-methyl-1-(methylsulfamoylamino)pentan-2-ol?
The InChIKey is UEIOGTVICZJQLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18N2O3S/c1-4-5-7(2,10)6-9-13(11,12)8-3/h8-10H,4-6H2,1-3H3.
What are the key properties of 2-methyl-1-(methylsulfamoylamino)pentan-2-ol?
2-methyl-1-(methylsulfamoylamino)pentan-2-ol has a molecular weight of 210.30 g/mol, XLogP of -0.41, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(methylsulfamoylamino)pentan-2-ol is sourced from PubChem (CID 106290478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).