2,5-dimethoxy-N,4-dimethylbenzenesulfonamide

C10H15NO4S — CID 50876508

IUPAC2,5-dimethoxy-N,4-dimethylbenzenesulfonamide
SMILESCNS(=O)(=O)c1cc(OC)c(C)cc1OC
InChIInChI=1S/C10H15NO4S/c1-7-5-9(15-4)10(6-8(7)14-3)16(12,13)11-2/h5-6,11H,1-4H3
InChIKeyMTVTZSBGHIYCGR-UHFFFAOYSA-N
MW245.30 g/mol
LogP0.92
Rot. Bonds4

About 2,5-dimethoxy-N,4-dimethylbenzenesulfonamide

2,5-dimethoxy-N,4-dimethylbenzenesulfonamide (PubChem CID 50876508) has the molecular formula C10H15NO4S and a molecular weight of 245.30 g/mol. Its IUPAC name is 2,5-dimethoxy-N,4-dimethylbenzenesulfonamide.

Molecular Properties

Compound Name2,5-dimethoxy-N,4-dimethylbenzenesulfonamide
PubChem CID50876508
Molecular FormulaC10H15NO4S
Molecular Weight245.30 g/mol
Exact Mass245.07
IUPAC Name2,5-dimethoxy-N,4-dimethylbenzenesulfonamide
SMILESCNS(=O)(=O)c1cc(OC)c(C)cc1OC
InChIInChI=1S/C10H15NO4S/c1-7-5-9(15-4)10(6-8(7)14-3)16(12,13)11-2/h5-6,11H,1-4H3
InChIKeyMTVTZSBGHIYCGR-UHFFFAOYSA-N
XLogP0.92
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.30
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methoxy-N,4,5-trimethylbenzenesulfonamide
CID 27243257
2-methoxy-4,5-dimethylbenzenesulfonohydrazide
CID 82081811
N-[(2R)-2-hydroxypropyl]-2,5-dimethoxy-4-methylbenzenesulfonamide
CID 51860924
N-cyclohexyl-2,5-dimethoxy-4-methylbenzenesulfonamide
CID 6464098
4-(2,5-dioxopyrrol-1-yl)-2,5-dimethoxy-N-methylbenzenesulfonamide
CID 21256278
(3,5-dimethylphenyl) 2,5-dimethoxy-4-methylbenzenesulfonate
CID 39845718
2,5-dimethoxy-4-methyl-N-(6-methyl-2-pyridinyl)benzenesulfonamide
CID 6463553
CID 70601990
CID 70601990
2-methoxy-4,5-dimethyl-N-(2-methylpropyl)benzenesulfonamide
CID 43845640
4-ethoxy-N,2,5-trimethylbenzenesulfonamide
CID 66485781
2,5-dimethoxy-4-methyl-N-(thiophen-2-ylmethyl)benzenesulfonamide
CID 6457434
1,4-dimethoxy-2,5-dimethylbenzene;dihydrochloride
CID 172845974

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethoxy-N,4-dimethylbenzenesulfonamide?
The IUPAC name of 2,5-dimethoxy-N,4-dimethylbenzenesulfonamide (CID 50876508) is 2,5-dimethoxy-N,4-dimethylbenzenesulfonamide.
What is the SMILES notation for 2,5-dimethoxy-N,4-dimethylbenzenesulfonamide?
The canonical SMILES for 2,5-dimethoxy-N,4-dimethylbenzenesulfonamide is CNS(=O)(=O)c1cc(OC)c(C)cc1OC.
What is the InChIKey of 2,5-dimethoxy-N,4-dimethylbenzenesulfonamide?
The InChIKey is MTVTZSBGHIYCGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO4S/c1-7-5-9(15-4)10(6-8(7)14-3)16(12,13)11-2/h5-6,11H,1-4H3.
What are the key properties of 2,5-dimethoxy-N,4-dimethylbenzenesulfonamide?
2,5-dimethoxy-N,4-dimethylbenzenesulfonamide has a molecular weight of 245.30 g/mol, XLogP of 0.92, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethoxy-N,4-dimethylbenzenesulfonamide is sourced from PubChem (CID 50876508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).