4-[(2-methylphenyl)methoxy]benzenesulfonamide

C14H15NO3S — CID 43164522

IUPAC4-[(2-methylphenyl)methoxy]benzenesulfonamide
SMILESCc1ccccc1COc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C14H15NO3S/c1-11-4-2-3-5-12(11)10-18-13-6-8-14(9-7-13)19(15,16)17/h2-9H,10H2,1H3,(H2,15,16,17)
InChIKeyCANWVODDWGXZFT-UHFFFAOYSA-N
MW277.35 g/mol
LogP2.22
Rot. Bonds4

About 4-[(2-methylphenyl)methoxy]benzenesulfonamide

4-[(2-methylphenyl)methoxy]benzenesulfonamide (PubChem CID 43164522) has the molecular formula C14H15NO3S and a molecular weight of 277.35 g/mol. Its IUPAC name is 4-[(2-methylphenyl)methoxy]benzenesulfonamide.

Molecular Properties

Compound Name4-[(2-methylphenyl)methoxy]benzenesulfonamide
PubChem CID43164522
Molecular FormulaC14H15NO3S
Molecular Weight277.35 g/mol
Exact Mass277.08
IUPAC Name4-[(2-methylphenyl)methoxy]benzenesulfonamide
SMILESCc1ccccc1COc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C14H15NO3S/c1-11-4-2-3-5-12(11)10-18-13-6-8-14(9-7-13)19(15,16)17/h2-9H,10H2,1H3,(H2,15,16,17)
InChIKeyCANWVODDWGXZFT-UHFFFAOYSA-N
XLogP2.22
TPSA69.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.35
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(2-methylphenyl)methyl]benzenesulfonamide
CID 139623698
2-[4-[(2-methylphenyl)methoxy]phenyl]ethanamine
CID 16775885
4-[(2-methylphenyl)methoxy]benzohydrazide
CID 17349910
2-[(4-methylsulfonylphenoxy)methyl]aniline
CID 43806870
N-[4-[(2-methylphenyl)methoxy]phenyl]acetamide
CID 7642527
4-N-methyl-4-N-[(2-methylphenyl)methyl]benzene-1,4-disulfonamide
CID 17410036
N-[[4-[(2-methylphenyl)methoxy]phenyl]methylideneamino]benzenesulfonamide
CID 1001906
(2-methylphenyl)methyl 2-chloro-5-sulfamoylbenzoate
CID 7994023
4-[(2,6-difluorophenyl)methoxy]benzenesulfonamide
CID 103981147
4-[4-[[2-[[4-(4-hydroxyphenyl)sulfonylphenoxy]methyl]phenyl]methoxy]phenyl]sulfonylphenol
CID 22020849
4-[3-(2-propylphenoxy)propoxy]benzenesulfonamide
CID 69222529
ethyl 2-hydroxy-2-[4-[(2-methylphenyl)methoxy]phenyl]propanoate
CID 54001053

Frequently Asked Questions

What is the IUPAC name of 4-[(2-methylphenyl)methoxy]benzenesulfonamide?
The IUPAC name of 4-[(2-methylphenyl)methoxy]benzenesulfonamide (CID 43164522) is 4-[(2-methylphenyl)methoxy]benzenesulfonamide.
What is the SMILES notation for 4-[(2-methylphenyl)methoxy]benzenesulfonamide?
The canonical SMILES for 4-[(2-methylphenyl)methoxy]benzenesulfonamide is Cc1ccccc1COc1ccc(S(N)(=O)=O)cc1.
What is the InChIKey of 4-[(2-methylphenyl)methoxy]benzenesulfonamide?
The InChIKey is CANWVODDWGXZFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO3S/c1-11-4-2-3-5-12(11)10-18-13-6-8-14(9-7-13)19(15,16)17/h2-9H,10H2,1H3,(H2,15,16,17).
What are the key properties of 4-[(2-methylphenyl)methoxy]benzenesulfonamide?
4-[(2-methylphenyl)methoxy]benzenesulfonamide has a molecular weight of 277.35 g/mol, XLogP of 2.22, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-methylphenyl)methoxy]benzenesulfonamide is sourced from PubChem (CID 43164522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).