5-fluoro-2-[(2-methoxyphenyl)methoxy]benzenesulfonamide

C14H14FNO4S — CID 62104803

IUPAC5-fluoro-2-[(2-methoxyphenyl)methoxy]benzenesulfonamide
SMILESCOc1ccccc1COc1ccc(F)cc1S(N)(=O)=O
InChIInChI=1S/C14H14FNO4S/c1-19-12-5-3-2-4-10(12)9-20-13-7-6-11(15)8-14(13)21(16,17)18/h2-8H,9H2,1H3,(H2,16,17,18)
InChIKeyOELMMAQHYTUTKO-UHFFFAOYSA-N
MW311.33 g/mol
LogP2.06
Rot. Bonds5

About 5-fluoro-2-[(2-methoxyphenyl)methoxy]benzenesulfonamide

5-fluoro-2-[(2-methoxyphenyl)methoxy]benzenesulfonamide (PubChem CID 62104803) has the molecular formula C14H14FNO4S and a molecular weight of 311.33 g/mol. Its IUPAC name is 5-fluoro-2-[(2-methoxyphenyl)methoxy]benzenesulfonamide.

Molecular Properties

Compound Name5-fluoro-2-[(2-methoxyphenyl)methoxy]benzenesulfonamide
PubChem CID62104803
Molecular FormulaC14H14FNO4S
Molecular Weight311.33 g/mol
Exact Mass311.06
IUPAC Name5-fluoro-2-[(2-methoxyphenyl)methoxy]benzenesulfonamide
SMILESCOc1ccccc1COc1ccc(F)cc1S(N)(=O)=O
InChIInChI=1S/C14H14FNO4S/c1-19-12-5-3-2-4-10(12)9-20-13-7-6-11(15)8-14(13)21(16,17)18/h2-8H,9H2,1H3,(H2,16,17,18)
InChIKeyOELMMAQHYTUTKO-UHFFFAOYSA-N
XLogP2.06
TPSA78.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.33
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(5-chloro-2-fluorophenyl)methoxy]-5-fluorobenzenesulfonamide
CID 103047119
2-[(4-fluoro-2-methylphenyl)methoxy]-5-methylbenzenesulfonamide
CID 114346410
2-[(4-chlorophenyl)methoxy]-5-fluorobenzenesulfonamide
CID 62105360
2-(3,3-dimethylbutoxy)-5-fluorobenzenesulfonamide
CID 62105180
5-fluoro-2-(3-fluoropropoxy)benzenesulfonamide
CID 81113508
1-[2-[(5-fluoro-2-methoxyphenyl)methoxy]phenyl]-N-methylmethanamine
CID 106484539
4-fluoro-2-(methoxymethyl)benzenesulfonamide
CID 83271454
2-(4-fluoro-2-sulfamoylphenoxy)acetic acid
CID 62103698
5-fluoro-2-(3-methylbut-3-enoxy)benzenesulfonamide
CID 114473030
2-[(2-chloro-3-fluorophenyl)methoxy]-5-methylbenzenesulfonamide
CID 115983170
3-methoxy-4-[(2-methoxyphenyl)methoxy]aniline
CID 22112878
4-methoxy-3-[(2-methoxyphenyl)methoxy]benzaldehyde
CID 60666587

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-[(2-methoxyphenyl)methoxy]benzenesulfonamide?
The IUPAC name of 5-fluoro-2-[(2-methoxyphenyl)methoxy]benzenesulfonamide (CID 62104803) is 5-fluoro-2-[(2-methoxyphenyl)methoxy]benzenesulfonamide.
What is the SMILES notation for 5-fluoro-2-[(2-methoxyphenyl)methoxy]benzenesulfonamide?
The canonical SMILES for 5-fluoro-2-[(2-methoxyphenyl)methoxy]benzenesulfonamide is COc1ccccc1COc1ccc(F)cc1S(N)(=O)=O.
What is the InChIKey of 5-fluoro-2-[(2-methoxyphenyl)methoxy]benzenesulfonamide?
The InChIKey is OELMMAQHYTUTKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FNO4S/c1-19-12-5-3-2-4-10(12)9-20-13-7-6-11(15)8-14(13)21(16,17)18/h2-8H,9H2,1H3,(H2,16,17,18).
What are the key properties of 5-fluoro-2-[(2-methoxyphenyl)methoxy]benzenesulfonamide?
5-fluoro-2-[(2-methoxyphenyl)methoxy]benzenesulfonamide has a molecular weight of 311.33 g/mol, XLogP of 2.06, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-[(2-methoxyphenyl)methoxy]benzenesulfonamide is sourced from PubChem (CID 62104803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).