4-fluoro-N-[2-(2-hydroxyethoxy)ethyl]benzenesulfonamide

C10H14FNO4S — CID 61248662

IUPAC4-fluoro-N-[2-(2-hydroxyethoxy)ethyl]benzenesulfonamide
SMILESO=S(=O)(NCCOCCO)c1ccc(F)cc1
InChIInChI=1S/C10H14FNO4S/c11-9-1-3-10(4-2-9)17(14,15)12-5-7-16-8-6-13/h1-4,12-13H,5-8H2
InChIKeyKPGBZAOJTUFTDR-UHFFFAOYSA-N
MW263.29 g/mol
LogP0.11
Rot. Bonds7

About 4-fluoro-N-[2-(2-hydroxyethoxy)ethyl]benzenesulfonamide

4-fluoro-N-[2-(2-hydroxyethoxy)ethyl]benzenesulfonamide (PubChem CID 61248662) has the molecular formula C10H14FNO4S and a molecular weight of 263.29 g/mol. Its IUPAC name is 4-fluoro-N-[2-(2-hydroxyethoxy)ethyl]benzenesulfonamide.

Molecular Properties

Compound Name4-fluoro-N-[2-(2-hydroxyethoxy)ethyl]benzenesulfonamide
PubChem CID61248662
Molecular FormulaC10H14FNO4S
Molecular Weight263.29 g/mol
Exact Mass263.06
IUPAC Name4-fluoro-N-[2-(2-hydroxyethoxy)ethyl]benzenesulfonamide
SMILESO=S(=O)(NCCOCCO)c1ccc(F)cc1
InChIInChI=1S/C10H14FNO4S/c11-9-1-3-10(4-2-9)17(14,15)12-5-7-16-8-6-13/h1-4,12-13H,5-8H2
InChIKeyKPGBZAOJTUFTDR-UHFFFAOYSA-N
XLogP0.11
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.29
LogP ≤ 50.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[2-[(4-fluorophenyl)sulfonylamino]ethoxy]acetic acid
CID 79457001
3-amino-5-fluoro-N-[2-(2-hydroxyethoxy)ethyl]benzenesulfonamide
CID 63322367
4-fluoro-N-[2-(4-fluorophenoxy)ethyl]benzenesulfonamide
CID 3127035
2-chloro-4-fluoro-N-[2-(2-hydroxyethoxy)ethyl]benzenesulfonamide
CID 55083819
4-fluoro-N-(2-propan-2-yloxyethyl)benzenesulfonamide
CID 110418282
3-N-[2-(2-hydroxyethoxy)ethyl]benzene-1,3-disulfonamide
CID 62497976
N-[2-(2-hydroxyethoxy)ethyl]-2-oxo-3H-1,3-benzoxazole-5-sulfonamide
CID 146024908
3-chloro-N-[2-(2-hydroxyethoxy)ethyl]-4-methoxybenzenesulfonamide
CID 62498134
3-amino-5-fluoro-N-[2-(2-hydroxyethoxy)ethyl]-4-methylbenzenesulfonamide
CID 116791811
4-fluoro-N-(2-methylprop-2-enyl)benzenesulfonamide
CID 114616524
N-[2-(4-ethoxyphenoxy)ethyl]-4-fluorobenzenesulfonamide
CID 40753911
1-(4-fluorophenyl)-N-[3-(2-hydroxyethoxy)propyl]methanesulfonamide
CID 104600551

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-[2-(2-hydroxyethoxy)ethyl]benzenesulfonamide?
The IUPAC name of 4-fluoro-N-[2-(2-hydroxyethoxy)ethyl]benzenesulfonamide (CID 61248662) is 4-fluoro-N-[2-(2-hydroxyethoxy)ethyl]benzenesulfonamide.
What is the SMILES notation for 4-fluoro-N-[2-(2-hydroxyethoxy)ethyl]benzenesulfonamide?
The canonical SMILES for 4-fluoro-N-[2-(2-hydroxyethoxy)ethyl]benzenesulfonamide is O=S(=O)(NCCOCCO)c1ccc(F)cc1.
What is the InChIKey of 4-fluoro-N-[2-(2-hydroxyethoxy)ethyl]benzenesulfonamide?
The InChIKey is KPGBZAOJTUFTDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FNO4S/c11-9-1-3-10(4-2-9)17(14,15)12-5-7-16-8-6-13/h1-4,12-13H,5-8H2.
What are the key properties of 4-fluoro-N-[2-(2-hydroxyethoxy)ethyl]benzenesulfonamide?
4-fluoro-N-[2-(2-hydroxyethoxy)ethyl]benzenesulfonamide has a molecular weight of 263.29 g/mol, XLogP of 0.11, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-[2-(2-hydroxyethoxy)ethyl]benzenesulfonamide is sourced from PubChem (CID 61248662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).