N-(2-fluoro-4-hydroxyphenyl)methanesulfonamide

C7H8FNO3S — CID 64786305

IUPACN-(2-fluoro-4-hydroxyphenyl)methanesulfonamide
SMILESCS(=O)(=O)Nc1ccc(O)cc1F
InChIInChI=1S/C7H8FNO3S/c1-13(11,12)9-7-3-2-5(10)4-6(7)8/h2-4,9-10H,1H3
InChIKeySAASMFIWZJHYEG-UHFFFAOYSA-N
MW205.21 g/mol
LogP0.90
Rot. Bonds2

About N-(2-fluoro-4-hydroxyphenyl)methanesulfonamide

N-(2-fluoro-4-hydroxyphenyl)methanesulfonamide (PubChem CID 64786305) has the molecular formula C7H8FNO3S and a molecular weight of 205.21 g/mol. Its IUPAC name is N-(2-fluoro-4-hydroxyphenyl)methanesulfonamide.

Molecular Properties

Compound NameN-(2-fluoro-4-hydroxyphenyl)methanesulfonamide
PubChem CID64786305
Molecular FormulaC7H8FNO3S
Molecular Weight205.21 g/mol
Exact Mass205.02
IUPAC NameN-(2-fluoro-4-hydroxyphenyl)methanesulfonamide
SMILESCS(=O)(=O)Nc1ccc(O)cc1F
InChIInChI=1S/C7H8FNO3S/c1-13(11,12)9-7-3-2-5(10)4-6(7)8/h2-4,9-10H,1H3
InChIKeySAASMFIWZJHYEG-UHFFFAOYSA-N
XLogP0.90
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.21
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'sulfonamide_B(41)', 'substructure': 'N/A'}, {'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Related Compounds

N-(2-fluoro-4-hydroxyphenyl)-2-methylsulfonylethanesulfonamide
CID 64787480
N-(2-fluoro-4-hydroxyphenyl)-2-methylpropane-1-sulfonamide
CID 64786303
N-[2-fluoro-4-[(E)-prop-1-enyl]phenyl]methanesulfonamide
CID 59156661
5-hydroxy-2-(methanesulfonamido)benzoic acid
CID 61406346
N-(2-fluoro-4-hydroxyphenyl)-5-methylthiophene-2-sulfonamide
CID 64786506
2-[3-fluoro-4-(methanesulfonamido)phenyl]acetamide
CID 68721183
N-[2-fluoro-4-(3-hydroxyprop-1-ynyl)phenyl]methanesulfonamide
CID 60813247
5-chloro-N-(2-fluoro-4-hydroxyphenyl)thiophene-2-sulfonamide
CID 64786901
N-[4-(cyanomethyl)-2-fluorophenyl]methanesulfonamide
CID 91179727
2-[3-fluoro-4-(methanesulfonamido)phenyl]-2-phenylacetic acid
CID 59637288
2-[3-fluoro-4-(methanesulfonamido)phenyl]-2-phenylpropanoic acid
CID 174593409
N-(2-hydroxy-4-methylphenyl)methanesulfonamide
CID 849290

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-4-hydroxyphenyl)methanesulfonamide?
The IUPAC name of N-(2-fluoro-4-hydroxyphenyl)methanesulfonamide (CID 64786305) is N-(2-fluoro-4-hydroxyphenyl)methanesulfonamide.
What is the SMILES notation for N-(2-fluoro-4-hydroxyphenyl)methanesulfonamide?
The canonical SMILES for N-(2-fluoro-4-hydroxyphenyl)methanesulfonamide is CS(=O)(=O)Nc1ccc(O)cc1F.
What is the InChIKey of N-(2-fluoro-4-hydroxyphenyl)methanesulfonamide?
The InChIKey is SAASMFIWZJHYEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8FNO3S/c1-13(11,12)9-7-3-2-5(10)4-6(7)8/h2-4,9-10H,1H3.
What are the key properties of N-(2-fluoro-4-hydroxyphenyl)methanesulfonamide?
N-(2-fluoro-4-hydroxyphenyl)methanesulfonamide has a molecular weight of 205.21 g/mol, XLogP of 0.90, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-4-hydroxyphenyl)methanesulfonamide is sourced from PubChem (CID 64786305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).