4-methoxy-3-[methyl(methylsulfonyl)amino]benzenesulfonamide

C9H14N2O5S2 — CID 7730636

IUPAC4-methoxy-3-[methyl(methylsulfonyl)amino]benzenesulfonamide
SMILESCOc1ccc(S(N)(=O)=O)cc1N(C)S(C)(=O)=O
InChIInChI=1S/C9H14N2O5S2/c1-11(17(3,12)13)8-6-7(18(10,14)15)4-5-9(8)16-2/h4-6H,1-3H3,(H2,10,14,15)
InChIKeyDBFKEKMFAUATHI-UHFFFAOYSA-N
MW294.35 g/mol
LogP-0.26
Rot. Bonds4

About 4-methoxy-3-[methyl(methylsulfonyl)amino]benzenesulfonamide

4-methoxy-3-[methyl(methylsulfonyl)amino]benzenesulfonamide (PubChem CID 7730636) has the molecular formula C9H14N2O5S2 and a molecular weight of 294.35 g/mol. Its IUPAC name is 4-methoxy-3-[methyl(methylsulfonyl)amino]benzenesulfonamide.

Molecular Properties

Compound Name4-methoxy-3-[methyl(methylsulfonyl)amino]benzenesulfonamide
PubChem CID7730636
Molecular FormulaC9H14N2O5S2
Molecular Weight294.35 g/mol
Exact Mass294.03
IUPAC Name4-methoxy-3-[methyl(methylsulfonyl)amino]benzenesulfonamide
SMILESCOc1ccc(S(N)(=O)=O)cc1N(C)S(C)(=O)=O
InChIInChI=1S/C9H14N2O5S2/c1-11(17(3,12)13)8-6-7(18(10,14)15)4-5-9(8)16-2/h4-6H,1-3H3,(H2,10,14,15)
InChIKeyDBFKEKMFAUATHI-UHFFFAOYSA-N
XLogP-0.26
TPSA106.77 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 5-0.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-methoxy-3-[methyl(methylsulfonyl)amino]benzenesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

CID 118692692
CID 118692692
N-(2-methoxyphenyl)-N-methylmethanesulfonamide
CID 61061885
4-[benzenesulfonyl(methyl)amino]-3-methoxybenzenesulfonamide
CID 34207194
3-(2-aminopropyl)-4-methoxybenzenesulfonamide
CID 67643235
2-methoxy-5-sulfamoylbenzamide;hydrochloride
CID 22748858
N-benzyl-3-[[4-methoxy-3-[methyl(methylsulfonyl)amino]phenyl]sulfonylamino]propanamide
CID 44654174
2-[(2-methoxy-5-sulfamoylbenzoyl)-methylamino]acetic acid
CID 119171965
3-(tert-butylsulfamoylamino)-4-methoxybenzenesulfonamide
CID 114812448
4-(3-bromo-4-methoxyphenyl)benzenesulfonamide
CID 57313510
1-ethyl-3-(2-methoxy-5-sulfamoylphenyl)-1-methylurea
CID 79162786
N-(2,5-dimethoxyphenyl)-3-fluoro-4-methoxy-N-methylbenzenesulfonamide
CID 100543133
3-chloro-4-(2-methoxyphenoxy)benzenesulfonamide
CID 61374264

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-3-[methyl(methylsulfonyl)amino]benzenesulfonamide?
The IUPAC name of 4-methoxy-3-[methyl(methylsulfonyl)amino]benzenesulfonamide (CID 7730636) is 4-methoxy-3-[methyl(methylsulfonyl)amino]benzenesulfonamide.
What is the SMILES notation for 4-methoxy-3-[methyl(methylsulfonyl)amino]benzenesulfonamide?
The canonical SMILES for 4-methoxy-3-[methyl(methylsulfonyl)amino]benzenesulfonamide is COc1ccc(S(N)(=O)=O)cc1N(C)S(C)(=O)=O.
What is the InChIKey of 4-methoxy-3-[methyl(methylsulfonyl)amino]benzenesulfonamide?
The InChIKey is DBFKEKMFAUATHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O5S2/c1-11(17(3,12)13)8-6-7(18(10,14)15)4-5-9(8)16-2/h4-6H,1-3H3,(H2,10,14,15).
What are the key properties of 4-methoxy-3-[methyl(methylsulfonyl)amino]benzenesulfonamide?
4-methoxy-3-[methyl(methylsulfonyl)amino]benzenesulfonamide has a molecular weight of 294.35 g/mol, XLogP of -0.26, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-3-[methyl(methylsulfonyl)amino]benzenesulfonamide is sourced from PubChem (CID 7730636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).