4-hydroxy-N-(thiolan-3-yl)benzenesulfonamide

C10H13NO3S2 — CID 103063928

IUPAC4-hydroxy-N-(thiolan-3-yl)benzenesulfonamide
SMILESO=S(=O)(NC1CCSC1)c1ccc(O)cc1
InChIInChI=1S/C10H13NO3S2/c12-9-1-3-10(4-2-9)16(13,14)11-8-5-6-15-7-8/h1-4,8,11-12H,5-7H2
InChIKeyLUOQWZDSFCBOSK-UHFFFAOYSA-N
MW259.35 g/mol
LogP1.18
Rot. Bonds3

About 4-hydroxy-N-(thiolan-3-yl)benzenesulfonamide

4-hydroxy-N-(thiolan-3-yl)benzenesulfonamide (PubChem CID 103063928) has the molecular formula C10H13NO3S2 and a molecular weight of 259.35 g/mol. Its IUPAC name is 4-hydroxy-N-(thiolan-3-yl)benzenesulfonamide.

Molecular Properties

Compound Name4-hydroxy-N-(thiolan-3-yl)benzenesulfonamide
PubChem CID103063928
Molecular FormulaC10H13NO3S2
Molecular Weight259.35 g/mol
Exact Mass259.03
IUPAC Name4-hydroxy-N-(thiolan-3-yl)benzenesulfonamide
SMILESO=S(=O)(NC1CCSC1)c1ccc(O)cc1
InChIInChI=1S/C10H13NO3S2/c12-9-1-3-10(4-2-9)16(13,14)11-8-5-6-15-7-8/h1-4,8,11-12H,5-7H2
InChIKeyLUOQWZDSFCBOSK-UHFFFAOYSA-N
XLogP1.18
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-acetyl-N-(thiolan-3-yl)benzenesulfonamide
CID 103697977
N-(thian-3-yl)benzenesulfonamide
CID 115675274
4-[2-(propylamino)ethyl]-N-(thiolan-3-yl)benzenesulfonamide
CID 106086339
6-cyano-N-(thiolan-3-yl)pyridine-3-sulfonamide
CID 103698000
3-(ethylaminomethyl)-N-(thiolan-3-yl)benzenesulfonamide
CID 106086182
2-(methylamino)-5-methylsulfonyl-N-(thiolan-3-yl)benzenesulfonamide
CID 103064611
2-amino-5-methylsulfonyl-N-(thiolan-3-yl)benzenesulfonamide
CID 103064624
5-bromo-N-(thiolan-3-yl)pyridine-3-sulfonamide
CID 103697980
3-(1-aminopropyl)-N-(thiolan-3-yl)benzenesulfonamide
CID 103063575
4-(3-aminopropoxy)-N-(thian-3-yl)benzenesulfonamide
CID 106081382
4-(cyanomethyl)-N-(thian-4-yl)benzenesulfonamide
CID 115671934
N-(thian-3-yl)-2,3-dihydro-1H-isoindole-5-sulfonamide
CID 107422407

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-(thiolan-3-yl)benzenesulfonamide?
The IUPAC name of 4-hydroxy-N-(thiolan-3-yl)benzenesulfonamide (CID 103063928) is 4-hydroxy-N-(thiolan-3-yl)benzenesulfonamide.
What is the SMILES notation for 4-hydroxy-N-(thiolan-3-yl)benzenesulfonamide?
The canonical SMILES for 4-hydroxy-N-(thiolan-3-yl)benzenesulfonamide is O=S(=O)(NC1CCSC1)c1ccc(O)cc1.
What is the InChIKey of 4-hydroxy-N-(thiolan-3-yl)benzenesulfonamide?
The InChIKey is LUOQWZDSFCBOSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO3S2/c12-9-1-3-10(4-2-9)16(13,14)11-8-5-6-15-7-8/h1-4,8,11-12H,5-7H2.
What are the key properties of 4-hydroxy-N-(thiolan-3-yl)benzenesulfonamide?
4-hydroxy-N-(thiolan-3-yl)benzenesulfonamide has a molecular weight of 259.35 g/mol, XLogP of 1.18, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-(thiolan-3-yl)benzenesulfonamide is sourced from PubChem (CID 103063928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).