3-chloro-N-(2-methoxyethyl)-N-methyl-5-sulfamoylbenzamide

C11H15ClN2O4S — CID 65388976

IUPAC3-chloro-N-(2-methoxyethyl)-N-methyl-5-sulfamoylbenzamide
SMILESCOCCN(C)C(=O)c1cc(Cl)cc(S(N)(=O)=O)c1
InChIInChI=1S/C11H15ClN2O4S/c1-14(3-4-18-2)11(15)8-5-9(12)7-10(6-8)19(13,16)17/h5-7H,3-4H2,1-2H3,(H2,13,16,17)
InChIKeyMAZJFIQRBIBMHI-UHFFFAOYSA-N
MW306.77 g/mol
LogP0.71
Rot. Bonds5

About 3-chloro-N-(2-methoxyethyl)-N-methyl-5-sulfamoylbenzamide

3-chloro-N-(2-methoxyethyl)-N-methyl-5-sulfamoylbenzamide (PubChem CID 65388976) has the molecular formula C11H15ClN2O4S and a molecular weight of 306.77 g/mol. Its IUPAC name is 3-chloro-N-(2-methoxyethyl)-N-methyl-5-sulfamoylbenzamide.

Molecular Properties

Compound Name3-chloro-N-(2-methoxyethyl)-N-methyl-5-sulfamoylbenzamide
PubChem CID65388976
Molecular FormulaC11H15ClN2O4S
Molecular Weight306.77 g/mol
Exact Mass306.04
IUPAC Name3-chloro-N-(2-methoxyethyl)-N-methyl-5-sulfamoylbenzamide
SMILESCOCCN(C)C(=O)c1cc(Cl)cc(S(N)(=O)=O)c1
InChIInChI=1S/C11H15ClN2O4S/c1-14(3-4-18-2)11(15)8-5-9(12)7-10(6-8)19(13,16)17/h5-7H,3-4H2,1-2H3,(H2,13,16,17)
InChIKeyMAZJFIQRBIBMHI-UHFFFAOYSA-N
XLogP0.71
TPSA89.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.77
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-chloro-N-ethyl-N-(2-methoxyethyl)-5-sulfamoylbenzamide
CID 65387830
3-chloro-5-[3-methoxypropyl(methyl)carbamoyl]benzenesulfonyl chloride
CID 65396840
3-chloro-N-(2,2-dimethylpropyl)-N-methyl-5-sulfamoylbenzamide
CID 65389265
3-(methoxymethyl)-N-methyl-N-propyl-5-sulfamoylbenzamide
CID 65387565
N-(2-methoxyethyl)-N,2,3-trimethyl-5-sulfamoylbenzamide
CID 65387633
3-chloro-N-(2-ethoxyethyl)-N-ethyl-5-sulfamoylbenzamide
CID 65388870
3-bromo-N-(2-ethoxyethyl)-N-methyl-5-sulfamoylbenzamide
CID 81074001
2-fluoro-N-(2-methoxyethyl)-N,3-dimethyl-5-sulfamoylbenzamide
CID 81478870
N-(2-methoxyethyl)-N-methyl-3-methylsulfonylbenzamide
CID 69372704
3-bromo-N-ethyl-N-(2-methoxyethyl)-5-sulfamoylbenzamide
CID 65386871
3-chloro-N-(3-methoxypropyl)-N,4-dimethyl-5-sulfamoylbenzamide
CID 65387897
3-chloro-N-cyclopentyl-N-methyl-5-sulfamoylbenzamide
CID 65388124

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-(2-methoxyethyl)-N-methyl-5-sulfamoylbenzamide?
The IUPAC name of 3-chloro-N-(2-methoxyethyl)-N-methyl-5-sulfamoylbenzamide (CID 65388976) is 3-chloro-N-(2-methoxyethyl)-N-methyl-5-sulfamoylbenzamide.
What is the SMILES notation for 3-chloro-N-(2-methoxyethyl)-N-methyl-5-sulfamoylbenzamide?
The canonical SMILES for 3-chloro-N-(2-methoxyethyl)-N-methyl-5-sulfamoylbenzamide is COCCN(C)C(=O)c1cc(Cl)cc(S(N)(=O)=O)c1.
What is the InChIKey of 3-chloro-N-(2-methoxyethyl)-N-methyl-5-sulfamoylbenzamide?
The InChIKey is MAZJFIQRBIBMHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2O4S/c1-14(3-4-18-2)11(15)8-5-9(12)7-10(6-8)19(13,16)17/h5-7H,3-4H2,1-2H3,(H2,13,16,17).
What are the key properties of 3-chloro-N-(2-methoxyethyl)-N-methyl-5-sulfamoylbenzamide?
3-chloro-N-(2-methoxyethyl)-N-methyl-5-sulfamoylbenzamide has a molecular weight of 306.77 g/mol, XLogP of 0.71, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-(2-methoxyethyl)-N-methyl-5-sulfamoylbenzamide is sourced from PubChem (CID 65388976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).