4-methoxy-2,6-dimethyl-N-(2-methylbutan-2-yl)benzenesulfonamide

C14H23NO3S — CID 47173285

IUPAC4-methoxy-2,6-dimethyl-N-(2-methylbutan-2-yl)benzenesulfonamide
SMILESCCC(C)(C)NS(=O)(=O)c1c(C)cc(OC)cc1C
InChIInChI=1S/C14H23NO3S/c1-7-14(4,5)15-19(16,17)13-10(2)8-12(18-6)9-11(13)3/h8-9,15H,7H2,1-6H3
InChIKeyXYZWXNYXLIVSIZ-UHFFFAOYSA-N
MW285.41 g/mol
LogP2.78
Rot. Bonds5

About 4-methoxy-2,6-dimethyl-N-(2-methylbutan-2-yl)benzenesulfonamide

4-methoxy-2,6-dimethyl-N-(2-methylbutan-2-yl)benzenesulfonamide (PubChem CID 47173285) has the molecular formula C14H23NO3S and a molecular weight of 285.41 g/mol. Its IUPAC name is 4-methoxy-2,6-dimethyl-N-(2-methylbutan-2-yl)benzenesulfonamide.

Molecular Properties

Compound Name4-methoxy-2,6-dimethyl-N-(2-methylbutan-2-yl)benzenesulfonamide
PubChem CID47173285
Molecular FormulaC14H23NO3S
Molecular Weight285.41 g/mol
Exact Mass285.14
IUPAC Name4-methoxy-2,6-dimethyl-N-(2-methylbutan-2-yl)benzenesulfonamide
SMILESCCC(C)(C)NS(=O)(=O)c1c(C)cc(OC)cc1C
InChIInChI=1S/C14H23NO3S/c1-7-14(4,5)15-19(16,17)13-10(2)8-12(18-6)9-11(13)3/h8-9,15H,7H2,1-6H3
InChIKeyXYZWXNYXLIVSIZ-UHFFFAOYSA-N
XLogP2.78
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.41
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-hydroxy-2-methylbutyl)-4-methoxy-2,6-dimethylbenzenesulfonamide
CID 65112859
4-methoxy-2,5-dimethyl-N-(2-methylbutan-2-yl)benzenesulfonamide
CID 47304384
6-methoxy-N-(2-methylbutan-2-yl)naphthalene-2-sulfonamide
CID 100505966
4-methoxy-3-methyl-N-(2-methylbutan-2-yl)benzenesulfonamide
CID 37478612
4-methyl-2-(methylaminomethyl)-N-(2-methylbutan-2-yl)thiophene-3-sulfonamide
CID 114138798
4-fluoro-2,6-dimethyl-N-(3-methylpentan-3-yl)benzenesulfonamide
CID 106328497
2-amino-6-methyl-N-(2-methylbutan-2-yl)benzenesulfonamide
CID 43452325
4-methoxy-2,6-dimethyl-N-[2-(1,3-thiazol-5-yl)ethyl]benzenesulfonamide
CID 110717621
2-(ethylaminomethyl)-4-methyl-N-(2-methylbutan-2-yl)thiophene-3-sulfonamide
CID 106031339
N,N-diethyl-4-methoxy-2,6-dimethylbenzenesulfonamide
CID 60754894
4-(ethylamino)-2,6-dimethyl-N-(3-methylpentan-3-yl)benzenesulfonamide
CID 106331206
2,6-dimethyl-4-(methylamino)-N-(3-methylpentan-3-yl)benzenesulfonamide
CID 106331213

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2,6-dimethyl-N-(2-methylbutan-2-yl)benzenesulfonamide?
The IUPAC name of 4-methoxy-2,6-dimethyl-N-(2-methylbutan-2-yl)benzenesulfonamide (CID 47173285) is 4-methoxy-2,6-dimethyl-N-(2-methylbutan-2-yl)benzenesulfonamide.
What is the SMILES notation for 4-methoxy-2,6-dimethyl-N-(2-methylbutan-2-yl)benzenesulfonamide?
The canonical SMILES for 4-methoxy-2,6-dimethyl-N-(2-methylbutan-2-yl)benzenesulfonamide is CCC(C)(C)NS(=O)(=O)c1c(C)cc(OC)cc1C.
What is the InChIKey of 4-methoxy-2,6-dimethyl-N-(2-methylbutan-2-yl)benzenesulfonamide?
The InChIKey is XYZWXNYXLIVSIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO3S/c1-7-14(4,5)15-19(16,17)13-10(2)8-12(18-6)9-11(13)3/h8-9,15H,7H2,1-6H3.
What are the key properties of 4-methoxy-2,6-dimethyl-N-(2-methylbutan-2-yl)benzenesulfonamide?
4-methoxy-2,6-dimethyl-N-(2-methylbutan-2-yl)benzenesulfonamide has a molecular weight of 285.41 g/mol, XLogP of 2.78, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2,6-dimethyl-N-(2-methylbutan-2-yl)benzenesulfonamide is sourced from PubChem (CID 47173285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).