3-hydroxy-N-(oxolan-3-yl)benzenesulfonamide

C10H13NO4S — CID 81258676

IUPAC3-hydroxy-N-(oxolan-3-yl)benzenesulfonamide
SMILESO=S(=O)(NC1CCOC1)c1cccc(O)c1
InChIInChI=1S/C10H13NO4S/c12-9-2-1-3-10(6-9)16(13,14)11-8-4-5-15-7-8/h1-3,6,8,11-12H,4-5,7H2
InChIKeyMXTGGQQZFYRQRX-UHFFFAOYSA-N
MW243.28 g/mol
LogP0.46
Rot. Bonds3

About 3-hydroxy-N-(oxolan-3-yl)benzenesulfonamide

3-hydroxy-N-(oxolan-3-yl)benzenesulfonamide (PubChem CID 81258676) has the molecular formula C10H13NO4S and a molecular weight of 243.28 g/mol. Its IUPAC name is 3-hydroxy-N-(oxolan-3-yl)benzenesulfonamide.

Molecular Properties

Compound Name3-hydroxy-N-(oxolan-3-yl)benzenesulfonamide
PubChem CID81258676
Molecular FormulaC10H13NO4S
Molecular Weight243.28 g/mol
Exact Mass243.06
IUPAC Name3-hydroxy-N-(oxolan-3-yl)benzenesulfonamide
SMILESO=S(=O)(NC1CCOC1)c1cccc(O)c1
InChIInChI=1S/C10H13NO4S/c12-9-2-1-3-10(6-9)16(13,14)11-8-4-5-15-7-8/h1-3,6,8,11-12H,4-5,7H2
InChIKeyMXTGGQQZFYRQRX-UHFFFAOYSA-N
XLogP0.46
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.28
LogP ≤ 50.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(oxolan-3-ylsulfamoyl)benzoic acid
CID 80717368
3-cyano-N-(oxolan-3-yl)benzenesulfonamide
CID 80714272
3-[(cyclopropylamino)methyl]-N-(oxolan-3-yl)benzenesulfonamide
CID 106072474
3-amino-N-(oxan-4-yl)benzenesulfonamide
CID 43609614
3-N-(oxan-4-yl)benzene-1,3-disulfonamide
CID 43610535
3-(oxan-4-ylsulfamoyl)benzenesulfonyl fluoride
CID 114958182
3-N-(oxan-3-yl)benzene-1,3-disulfonamide
CID 63361521
3-hydroxy-N-(3-methoxycyclopentyl)benzenesulfonamide
CID 114118203
3-[[(3R)-oxolan-3-yl]sulfamoyl]-N-(2,2,2-trifluoroethyl)benzamide
CID 99819133
N-(oxan-3-yl)benzenesulfonamide
CID 63613851
2-iodo-5-(oxolan-3-ylsulfamoyl)benzoic acid
CID 103962619
4-acetyl-N-(oxolan-3-yl)benzenesulfonamide
CID 80712927

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-(oxolan-3-yl)benzenesulfonamide?
The IUPAC name of 3-hydroxy-N-(oxolan-3-yl)benzenesulfonamide (CID 81258676) is 3-hydroxy-N-(oxolan-3-yl)benzenesulfonamide.
What is the SMILES notation for 3-hydroxy-N-(oxolan-3-yl)benzenesulfonamide?
The canonical SMILES for 3-hydroxy-N-(oxolan-3-yl)benzenesulfonamide is O=S(=O)(NC1CCOC1)c1cccc(O)c1.
What is the InChIKey of 3-hydroxy-N-(oxolan-3-yl)benzenesulfonamide?
The InChIKey is MXTGGQQZFYRQRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO4S/c12-9-2-1-3-10(6-9)16(13,14)11-8-4-5-15-7-8/h1-3,6,8,11-12H,4-5,7H2.
What are the key properties of 3-hydroxy-N-(oxolan-3-yl)benzenesulfonamide?
3-hydroxy-N-(oxolan-3-yl)benzenesulfonamide has a molecular weight of 243.28 g/mol, XLogP of 0.46, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-(oxolan-3-yl)benzenesulfonamide is sourced from PubChem (CID 81258676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).