N-(2-fluoro-3-hydroxyphenyl)-2-methoxybenzenesulfonamide

C13H12FNO4S — CID 138995627

IUPACN-(2-fluoro-3-hydroxyphenyl)-2-methoxybenzenesulfonamide
SMILESCOc1ccccc1S(=O)(=O)Nc1cccc(O)c1F
InChIInChI=1S/C13H12FNO4S/c1-19-11-7-2-3-8-12(11)20(17,18)15-9-5-4-6-10(16)13(9)14/h2-8,15-16H,1H3
InChIKeyAPILUNZRKBFJNJ-UHFFFAOYSA-N
MW297.31 g/mol
LogP2.34
Rot. Bonds4

About N-(2-fluoro-3-hydroxyphenyl)-2-methoxybenzenesulfonamide

N-(2-fluoro-3-hydroxyphenyl)-2-methoxybenzenesulfonamide (PubChem CID 138995627) has the molecular formula C13H12FNO4S and a molecular weight of 297.31 g/mol. Its IUPAC name is N-(2-fluoro-3-hydroxyphenyl)-2-methoxybenzenesulfonamide.

Molecular Properties

Compound NameN-(2-fluoro-3-hydroxyphenyl)-2-methoxybenzenesulfonamide
PubChem CID138995627
Molecular FormulaC13H12FNO4S
Molecular Weight297.31 g/mol
Exact Mass297.05
IUPAC NameN-(2-fluoro-3-hydroxyphenyl)-2-methoxybenzenesulfonamide
SMILESCOc1ccccc1S(=O)(=O)Nc1cccc(O)c1F
InChIInChI=1S/C13H12FNO4S/c1-19-11-7-2-3-8-12(11)20(17,18)15-9-5-4-6-10(16)13(9)14/h2-8,15-16H,1H3
InChIKeyAPILUNZRKBFJNJ-UHFFFAOYSA-N
XLogP2.34
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.31
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-methoxy-3-[(2-methoxyphenyl)sulfonylamino]benzenesulfonamide
CID 168867113
3-chloro-N-(2-fluoro-3-hydroxyphenyl)-2-hydroxybenzenesulfonamide
CID 139011372
N-(2-bromophenyl)-2-methoxybenzenesulfonamide
CID 47104314
methyl 2-[(2-methoxyphenyl)sulfonylamino]benzoate
CID 110757322
2-[(2-methoxyphenyl)sulfonylamino]benzoic acid
CID 43091453
2-methoxy-N-[2-(2,2,2-trifluoroethylamino)phenyl]benzenesulfonamide
CID 47784110
3-[(2-methoxyphenyl)sulfonylamino]-2-methylbenzamide
CID 86983204
5-amino-2-fluoro-N-(2-methoxyphenyl)benzenesulfonamide
CID 43255479
5-chloro-N-(2-hydroxyphenyl)-2-methoxybenzenesulfonamide
CID 4664874
N-(2-bromo-3-pyridinyl)-2-methoxybenzenesulfonamide
CID 103816000
sodium;hydride;2,3,4,5,6-pentafluoro-N-(2-hydroxy-3-methoxyphenyl)benzenesulfonamide
CID 173238277
3-amino-5-chloro-2-fluoro-N-(2-methoxyphenyl)benzenesulfonamide
CID 103050320

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-3-hydroxyphenyl)-2-methoxybenzenesulfonamide?
The IUPAC name of N-(2-fluoro-3-hydroxyphenyl)-2-methoxybenzenesulfonamide (CID 138995627) is N-(2-fluoro-3-hydroxyphenyl)-2-methoxybenzenesulfonamide.
What is the SMILES notation for N-(2-fluoro-3-hydroxyphenyl)-2-methoxybenzenesulfonamide?
The canonical SMILES for N-(2-fluoro-3-hydroxyphenyl)-2-methoxybenzenesulfonamide is COc1ccccc1S(=O)(=O)Nc1cccc(O)c1F.
What is the InChIKey of N-(2-fluoro-3-hydroxyphenyl)-2-methoxybenzenesulfonamide?
The InChIKey is APILUNZRKBFJNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FNO4S/c1-19-11-7-2-3-8-12(11)20(17,18)15-9-5-4-6-10(16)13(9)14/h2-8,15-16H,1H3.
What are the key properties of N-(2-fluoro-3-hydroxyphenyl)-2-methoxybenzenesulfonamide?
N-(2-fluoro-3-hydroxyphenyl)-2-methoxybenzenesulfonamide has a molecular weight of 297.31 g/mol, XLogP of 2.34, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-3-hydroxyphenyl)-2-methoxybenzenesulfonamide is sourced from PubChem (CID 138995627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).