4-methoxy-N-(4-methoxy-2,6-dimethylphenyl)benzenesulfonamide

C16H19NO4S — CID 118707084

IUPAC4-methoxy-N-(4-methoxy-2,6-dimethylphenyl)benzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2c(C)cc(OC)cc2C)cc1
InChIInChI=1S/C16H19NO4S/c1-11-9-14(21-4)10-12(2)16(11)17-22(18,19)15-7-5-13(20-3)6-8-15/h5-10,17H,1-4H3
InChIKeyNNHBFMKUJCKZBD-UHFFFAOYSA-N
MW321.40 g/mol
LogP3.12
Rot. Bonds5

About 4-methoxy-N-(4-methoxy-2,6-dimethylphenyl)benzenesulfonamide

4-methoxy-N-(4-methoxy-2,6-dimethylphenyl)benzenesulfonamide (PubChem CID 118707084) has the molecular formula C16H19NO4S and a molecular weight of 321.40 g/mol. Its IUPAC name is 4-methoxy-N-(4-methoxy-2,6-dimethylphenyl)benzenesulfonamide.

Molecular Properties

Compound Name4-methoxy-N-(4-methoxy-2,6-dimethylphenyl)benzenesulfonamide
PubChem CID118707084
Molecular FormulaC16H19NO4S
Molecular Weight321.40 g/mol
Exact Mass321.10
IUPAC Name4-methoxy-N-(4-methoxy-2,6-dimethylphenyl)benzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2c(C)cc(OC)cc2C)cc1
InChIInChI=1S/C16H19NO4S/c1-11-9-14(21-4)10-12(2)16(11)17-22(18,19)15-7-5-13(20-3)6-8-15/h5-10,17H,1-4H3
InChIKeyNNHBFMKUJCKZBD-UHFFFAOYSA-N
XLogP3.12
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.40
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-Ethoxyphenyl)-4-methylbenzenesulfonamide
CID 284083
N-(4-hydroxy-2,6-dimethylphenyl)-4-methoxybenzenesulfonamide
CID 2906141
4-methoxy-N-(2,4,6-trimethylphenyl)benzenesulfonamide
CID 743974
N-(4-methoxyphenyl)-2,5-dimethylbenzenesulfonamide
CID 2442232
N-(2-Biphenylyl)-4-methoxybenzenesulfonamide
CID 3333876
4-methoxy-N-[2-(trifluoromethyl)phenyl]benzenesulfonamide
CID 755970
4-methoxy-N-(2-methylphenyl)benzenesulfonamide
CID 796476
N-(4-hydroxy-2,6-dimethylphenyl)benzenesulfonamide
CID 747919
N-(4-hydroxy-2-methyl-5-propan-2-ylphenyl)-4-methoxybenzenesulfonamide
CID 706367
N-(4-ethoxyphenyl)-4-methoxy-3-methylbenzenesulfonamide
CID 893786
N-(4-fluoro-2,6-dimethylphenyl)-4-methoxybenzenesulfonamide
CID 118707082
N-(4-chloro-2,6-dimethylphenyl)-4-methoxybenzenesulfonamide
CID 118707083

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-(4-methoxy-2,6-dimethylphenyl)benzenesulfonamide?
The IUPAC name of 4-methoxy-N-(4-methoxy-2,6-dimethylphenyl)benzenesulfonamide (CID 118707084) is 4-methoxy-N-(4-methoxy-2,6-dimethylphenyl)benzenesulfonamide.
What is the SMILES notation for 4-methoxy-N-(4-methoxy-2,6-dimethylphenyl)benzenesulfonamide?
The canonical SMILES for 4-methoxy-N-(4-methoxy-2,6-dimethylphenyl)benzenesulfonamide is COc1ccc(S(=O)(=O)Nc2c(C)cc(OC)cc2C)cc1.
What is the InChIKey of 4-methoxy-N-(4-methoxy-2,6-dimethylphenyl)benzenesulfonamide?
The InChIKey is NNHBFMKUJCKZBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO4S/c1-11-9-14(21-4)10-12(2)16(11)17-22(18,19)15-7-5-13(20-3)6-8-15/h5-10,17H,1-4H3.
What are the key properties of 4-methoxy-N-(4-methoxy-2,6-dimethylphenyl)benzenesulfonamide?
4-methoxy-N-(4-methoxy-2,6-dimethylphenyl)benzenesulfonamide has a molecular weight of 321.40 g/mol, XLogP of 3.12, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(4-methoxy-2,6-dimethylphenyl)benzenesulfonamide is sourced from PubChem (CID 118707084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).