3,5-dimethoxy-N-[2-(methylsulfamoyl)ethyl]benzamide

C12H18N2O5S — CID 7619022

IUPAC3,5-dimethoxy-N-[2-(methylsulfamoyl)ethyl]benzamide
SMILESCNS(=O)(=O)CCNC(=O)c1cc(OC)cc(OC)c1
InChIInChI=1S/C12H18N2O5S/c1-13-20(16,17)5-4-14-12(15)9-6-10(18-2)8-11(7-9)19-3/h6-8,13H,4-5H2,1-3H3,(H,14,15)
InChIKeyWQCNGCHFCFSXCG-UHFFFAOYSA-N
MW302.35 g/mol
LogP-0.02
Rot. Bonds7

About 3,5-dimethoxy-N-[2-(methylsulfamoyl)ethyl]benzamide

3,5-dimethoxy-N-[2-(methylsulfamoyl)ethyl]benzamide (PubChem CID 7619022) has the molecular formula C12H18N2O5S and a molecular weight of 302.35 g/mol. Its IUPAC name is 3,5-dimethoxy-N-[2-(methylsulfamoyl)ethyl]benzamide.

Molecular Properties

Compound Name3,5-dimethoxy-N-[2-(methylsulfamoyl)ethyl]benzamide
PubChem CID7619022
Molecular FormulaC12H18N2O5S
Molecular Weight302.35 g/mol
Exact Mass302.09
IUPAC Name3,5-dimethoxy-N-[2-(methylsulfamoyl)ethyl]benzamide
SMILESCNS(=O)(=O)CCNC(=O)c1cc(OC)cc(OC)c1
InChIInChI=1S/C12H18N2O5S/c1-13-20(16,17)5-4-14-12(15)9-6-10(18-2)8-11(7-9)19-3/h6-8,13H,4-5H2,1-3H3,(H,14,15)
InChIKeyWQCNGCHFCFSXCG-UHFFFAOYSA-N
XLogP-0.02
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.35
LogP ≤ 5-0.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(ethylsulfamoyl)ethyl]-3,5-dimethoxybenzamide
CID 7619023
N-[4-[(3,5-dimethoxybenzoyl)amino]butyl]-3,5-dimethoxybenzamide
CID 2933573
N-[2-[bis(2-methylpropyl)sulfamoyl]ethyl]-3,5-dimethoxybenzamide
CID 7618951
2-bromo-5-methoxy-N-[2-(methylsulfamoyl)ethyl]benzamide
CID 102685066
N-[2-[(3,5-dimethoxybenzoyl)amino]ethyl]-3,5-dihydroxybenzamide
CID 108539471
N-[2-(butanoylamino)ethyl]-3,5-dimethoxybenzamide
CID 108571368
3,5-difluoro-4-hydrazinyl-N-[2-(methylsulfamoyl)ethyl]benzamide
CID 106340860
N-ethyl-3,5-dimethoxybenzamide
CID 4286127
N-(2-aminooxyethyl)-3,5-dimethoxybenzamide
CID 92931838
3,5-dimethoxy-N-[2-(propan-2-ylamino)ethyl]benzamide
CID 62663294
4-[2-(methylsulfamoyl)ethylcarbamoyl]benzoic acid
CID 106341777
N-[2-(methylsulfamoyl)ethyl]-4-sulfanylbenzamide
CID 114175650

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethoxy-N-[2-(methylsulfamoyl)ethyl]benzamide?
The IUPAC name of 3,5-dimethoxy-N-[2-(methylsulfamoyl)ethyl]benzamide (CID 7619022) is 3,5-dimethoxy-N-[2-(methylsulfamoyl)ethyl]benzamide.
What is the SMILES notation for 3,5-dimethoxy-N-[2-(methylsulfamoyl)ethyl]benzamide?
The canonical SMILES for 3,5-dimethoxy-N-[2-(methylsulfamoyl)ethyl]benzamide is CNS(=O)(=O)CCNC(=O)c1cc(OC)cc(OC)c1.
What is the InChIKey of 3,5-dimethoxy-N-[2-(methylsulfamoyl)ethyl]benzamide?
The InChIKey is WQCNGCHFCFSXCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O5S/c1-13-20(16,17)5-4-14-12(15)9-6-10(18-2)8-11(7-9)19-3/h6-8,13H,4-5H2,1-3H3,(H,14,15).
What are the key properties of 3,5-dimethoxy-N-[2-(methylsulfamoyl)ethyl]benzamide?
3,5-dimethoxy-N-[2-(methylsulfamoyl)ethyl]benzamide has a molecular weight of 302.35 g/mol, XLogP of -0.02, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethoxy-N-[2-(methylsulfamoyl)ethyl]benzamide is sourced from PubChem (CID 7619022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).