2-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]benzenesulfonamide

C11H18N2O5S2 — CID 81245129

IUPAC2-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]benzenesulfonamide
SMILESCC(C)(CNS(=O)(=O)c1ccccc1O)NS(C)(=O)=O
InChIInChI=1S/C11H18N2O5S2/c1-11(2,13-19(3,15)16)8-12-20(17,18)10-7-5-4-6-9(10)14/h4-7,12-14H,8H2,1-3H3
InChIKeyNSNYLEXDELLOBV-UHFFFAOYSA-N
MW322.41 g/mol
LogP-0.00
Rot. Bonds6

About 2-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]benzenesulfonamide

2-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]benzenesulfonamide (PubChem CID 81245129) has the molecular formula C11H18N2O5S2 and a molecular weight of 322.41 g/mol. Its IUPAC name is 2-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]benzenesulfonamide.

Molecular Properties

Compound Name2-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]benzenesulfonamide
PubChem CID81245129
Molecular FormulaC11H18N2O5S2
Molecular Weight322.41 g/mol
Exact Mass322.07
IUPAC Name2-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]benzenesulfonamide
SMILESCC(C)(CNS(=O)(=O)c1ccccc1O)NS(C)(=O)=O
InChIInChI=1S/C11H18N2O5S2/c1-11(2,13-19(3,15)16)8-12-20(17,18)10-7-5-4-6-9(10)14/h4-7,12-14H,8H2,1-3H3
InChIKeyNSNYLEXDELLOBV-UHFFFAOYSA-N
XLogP-0.00
TPSA112.57 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 5-0.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-hydroxy-N-(3-methylbut-2-enyl)benzenesulfonamide
CID 106191097
N-[(4-ethylphenyl)methyl]-2-hydroxybenzenesulfonamide
CID 106900408
6-chloro-N-[2-(methanesulfonamido)-2-methylpropyl]pyridine-3-sulfonamide
CID 63864494
N-[2-(methanesulfonamido)-2-methylpropyl]-6-(methylamino)pyridine-3-sulfonamide
CID 63862617
4-bromo-3-fluoro-N-[2-(methanesulfonamido)-2-methylpropyl]benzenesulfonamide
CID 103697603
N-[2-(methanesulfonamido)-2-methylpropyl]-1H-pyrazole-4-sulfonamide
CID 63859195
N-[3-(dimethylamino)propyl]-2-hydroxybenzenesulfonamide
CID 81242201
3-amino-N-[2-(methanesulfonamido)-2-methylpropyl]-5-methylbenzenesulfonamide
CID 63862103
2-methyl-N-(2-methyl-2-methylsulfonylpropyl)benzenesulfonamide
CID 79556754
N-[1-(methanesulfonamido)-2-methylpropan-2-yl]-1,3-dihydro-2-benzofuran-4-sulfonamide
CID 166395443
N-[2-methyl-2-(1-phenylethylamino)propyl]-2-methylsulfonylbenzenesulfonamide
CID 56541430
N-[(5-ethylthiophen-2-yl)methyl]-2-hydroxybenzenesulfonamide
CID 106011763

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]benzenesulfonamide?
The IUPAC name of 2-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]benzenesulfonamide (CID 81245129) is 2-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]benzenesulfonamide.
What is the SMILES notation for 2-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]benzenesulfonamide?
The canonical SMILES for 2-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]benzenesulfonamide is CC(C)(CNS(=O)(=O)c1ccccc1O)NS(C)(=O)=O.
What is the InChIKey of 2-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]benzenesulfonamide?
The InChIKey is NSNYLEXDELLOBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O5S2/c1-11(2,13-19(3,15)16)8-12-20(17,18)10-7-5-4-6-9(10)14/h4-7,12-14H,8H2,1-3H3.
What are the key properties of 2-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]benzenesulfonamide?
2-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]benzenesulfonamide has a molecular weight of 322.41 g/mol, XLogP of -0.00, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]benzenesulfonamide is sourced from PubChem (CID 81245129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).