2-hydroxy-N-[1-(oxolan-2-yl)ethyl]benzenesulfonamide

C12H17NO4S — CID 81241326

IUPAC2-hydroxy-N-[1-(oxolan-2-yl)ethyl]benzenesulfonamide
SMILESCC(NS(=O)(=O)c1ccccc1O)C1CCCO1
InChIInChI=1S/C12H17NO4S/c1-9(11-6-4-8-17-11)13-18(15,16)12-7-3-2-5-10(12)14/h2-3,5,7,9,11,13-14H,4,6,8H2,1H3
InChIKeyDJJDOXDOZWMGOD-UHFFFAOYSA-N
MW271.34 g/mol
LogP1.24
Rot. Bonds4

About 2-hydroxy-N-[1-(oxolan-2-yl)ethyl]benzenesulfonamide

2-hydroxy-N-[1-(oxolan-2-yl)ethyl]benzenesulfonamide (PubChem CID 81241326) has the molecular formula C12H17NO4S and a molecular weight of 271.34 g/mol. Its IUPAC name is 2-hydroxy-N-[1-(oxolan-2-yl)ethyl]benzenesulfonamide.

Molecular Properties

Compound Name2-hydroxy-N-[1-(oxolan-2-yl)ethyl]benzenesulfonamide
PubChem CID81241326
Molecular FormulaC12H17NO4S
Molecular Weight271.34 g/mol
Exact Mass271.09
IUPAC Name2-hydroxy-N-[1-(oxolan-2-yl)ethyl]benzenesulfonamide
SMILESCC(NS(=O)(=O)c1ccccc1O)C1CCCO1
InChIInChI=1S/C12H17NO4S/c1-9(11-6-4-8-17-11)13-18(15,16)12-7-3-2-5-10(12)14/h2-3,5,7,9,11,13-14H,4,6,8H2,1H3
InChIKeyDJJDOXDOZWMGOD-UHFFFAOYSA-N
XLogP1.24
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.34
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-4-[1-(oxolan-2-yl)ethylsulfamoyl]furan-2-carboxylic acid
CID 62829523
3-bromo-4-[1-(oxolan-2-yl)ethylsulfamoyl]benzoic acid
CID 43533875
4-chloro-N-[1-(oxolan-2-yl)ethyl]benzenesulfonamide
CID 6465192
3-[1-(oxolan-2-yl)ethylsulfamoyl]benzenesulfonyl chloride
CID 43533925
methyl 3-chloro-4-[[(1R)-1-[(2R)-oxolan-2-yl]ethyl]sulfamoyl]benzoate
CID 94812176
4,5-dimethoxy-2-methyl-N-[(1S)-1-[(2S)-oxolan-2-yl]ethyl]benzenesulfonamide
CID 35611524
N-[1-(oxolan-2-yl)ethyl]-3-propanoylbenzenesulfonamide
CID 60873458
2-amino-5-nitro-N-[1-(oxolan-2-yl)ethyl]benzenesulfonamide
CID 62146601
N-[1-(oxolan-2-yl)ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
CID 42955258
2-chloro-N-[1-(oxolan-2-yl)ethyl]-1,3-thiazole-5-sulfonamide
CID 43533896
3-hydrazinyl-N-[1-(oxolan-2-yl)ethyl]pyridine-2-sulfonamide
CID 103300982
2-amino-5-bromo-N-[1-(oxolan-2-yl)ethyl]pyridine-3-sulfonamide
CID 55043444

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[1-(oxolan-2-yl)ethyl]benzenesulfonamide?
The IUPAC name of 2-hydroxy-N-[1-(oxolan-2-yl)ethyl]benzenesulfonamide (CID 81241326) is 2-hydroxy-N-[1-(oxolan-2-yl)ethyl]benzenesulfonamide.
What is the SMILES notation for 2-hydroxy-N-[1-(oxolan-2-yl)ethyl]benzenesulfonamide?
The canonical SMILES for 2-hydroxy-N-[1-(oxolan-2-yl)ethyl]benzenesulfonamide is CC(NS(=O)(=O)c1ccccc1O)C1CCCO1.
What is the InChIKey of 2-hydroxy-N-[1-(oxolan-2-yl)ethyl]benzenesulfonamide?
The InChIKey is DJJDOXDOZWMGOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO4S/c1-9(11-6-4-8-17-11)13-18(15,16)12-7-3-2-5-10(12)14/h2-3,5,7,9,11,13-14H,4,6,8H2,1H3.
What are the key properties of 2-hydroxy-N-[1-(oxolan-2-yl)ethyl]benzenesulfonamide?
2-hydroxy-N-[1-(oxolan-2-yl)ethyl]benzenesulfonamide has a molecular weight of 271.34 g/mol, XLogP of 1.24, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[1-(oxolan-2-yl)ethyl]benzenesulfonamide is sourced from PubChem (CID 81241326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).