4-[methoxy(methyl)sulfamoyl]benzamide

C9H12N2O4S — CID 47116565

IUPAC4-[methoxy(methyl)sulfamoyl]benzamide
SMILESCON(C)S(=O)(=O)c1ccc(C(N)=O)cc1
InChIInChI=1S/C9H12N2O4S/c1-11(15-2)16(13,14)8-5-3-7(4-6-8)9(10)12/h3-6H,1-2H3,(H2,10,12)
InChIKeyBDMXVNNRQSMSKX-UHFFFAOYSA-N
MW244.27 g/mol
LogP-0.03
Rot. Bonds4

About 4-[methoxy(methyl)sulfamoyl]benzamide

4-[methoxy(methyl)sulfamoyl]benzamide (PubChem CID 47116565) has the molecular formula C9H12N2O4S and a molecular weight of 244.27 g/mol. Its IUPAC name is 4-[methoxy(methyl)sulfamoyl]benzamide.

Molecular Properties

Compound Name4-[methoxy(methyl)sulfamoyl]benzamide
PubChem CID47116565
Molecular FormulaC9H12N2O4S
Molecular Weight244.27 g/mol
Exact Mass244.05
IUPAC Name4-[methoxy(methyl)sulfamoyl]benzamide
SMILESCON(C)S(=O)(=O)c1ccc(C(N)=O)cc1
InChIInChI=1S/C9H12N2O4S/c1-11(15-2)16(13,14)8-5-3-7(4-6-8)9(10)12/h3-6H,1-2H3,(H2,10,12)
InChIKeyBDMXVNNRQSMSKX-UHFFFAOYSA-N
XLogP-0.03
TPSA89.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.27
LogP ≤ 5-0.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

methyl 4-[methoxy(methyl)sulfamoyl]benzoate
CID 35459995
4-amino-N-methoxy-N-methylbenzenesulfonamide
CID 4962658
methyl 3-[(4-carbamoylphenyl)sulfonyl-methylamino]-2-methylpropanoate
CID 61059514
4-[(4-methoxyphenyl)sulfonyl-methylamino]benzamide
CID 967709
4-[[(4-tert-butylbenzoyl)amino]carbamoyl]-N-methoxy-N-methylbenzenesulfonamide
CID 9327451
[2-(4-chlorophenyl)-2-oxoethyl] 4-[methoxy(methyl)sulfamoyl]benzoate
CID 8943217
4-[methoxy(methyl)sulfamoyl]-N-(1,3,4-thiadiazol-2-yl)benzamide
CID 29370312
4-[ethyl(hydroxy)sulfamoyl]benzamide
CID 91012297
4-[(3-amino-2,2-dimethylpropyl)-methylsulfamoyl]benzamide
CID 79652029
[2-(N-methylanilino)-2-oxoethyl] 4-[methoxy(methyl)sulfamoyl]benzoate
CID 8943232
N-cyclooctyl-4-[methoxy(methyl)sulfamoyl]benzamide
CID 17490358
4-[methoxy(methyl)sulfamoyl]-N-(4-methylpiperazin-1-yl)benzamide
CID 9205648

Frequently Asked Questions

What is the IUPAC name of 4-[methoxy(methyl)sulfamoyl]benzamide?
The IUPAC name of 4-[methoxy(methyl)sulfamoyl]benzamide (CID 47116565) is 4-[methoxy(methyl)sulfamoyl]benzamide.
What is the SMILES notation for 4-[methoxy(methyl)sulfamoyl]benzamide?
The canonical SMILES for 4-[methoxy(methyl)sulfamoyl]benzamide is CON(C)S(=O)(=O)c1ccc(C(N)=O)cc1.
What is the InChIKey of 4-[methoxy(methyl)sulfamoyl]benzamide?
The InChIKey is BDMXVNNRQSMSKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O4S/c1-11(15-2)16(13,14)8-5-3-7(4-6-8)9(10)12/h3-6H,1-2H3,(H2,10,12).
What are the key properties of 4-[methoxy(methyl)sulfamoyl]benzamide?
4-[methoxy(methyl)sulfamoyl]benzamide has a molecular weight of 244.27 g/mol, XLogP of -0.03, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[methoxy(methyl)sulfamoyl]benzamide is sourced from PubChem (CID 47116565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).