3-chloro-N-(1-cyclobutylethyl)-2-methyl-5-sulfamoylbenzamide

C14H19ClN2O3S — CID 107101061

IUPAC3-chloro-N-(1-cyclobutylethyl)-2-methyl-5-sulfamoylbenzamide
SMILESCc1c(Cl)cc(S(N)(=O)=O)cc1C(=O)NC(C)C1CCC1
InChIInChI=1S/C14H19ClN2O3S/c1-8-12(6-11(7-13(8)15)21(16,19)20)14(18)17-9(2)10-4-3-5-10/h6-7,9-10H,3-5H2,1-2H3,(H,17,18)(H2,16,19,20)
InChIKeySWPIGVCXNZZOAU-UHFFFAOYSA-N
MW330.84 g/mol
LogP2.21
Rot. Bonds4

About 3-chloro-N-(1-cyclobutylethyl)-2-methyl-5-sulfamoylbenzamide

3-chloro-N-(1-cyclobutylethyl)-2-methyl-5-sulfamoylbenzamide (PubChem CID 107101061) has the molecular formula C14H19ClN2O3S and a molecular weight of 330.84 g/mol. Its IUPAC name is 3-chloro-N-(1-cyclobutylethyl)-2-methyl-5-sulfamoylbenzamide.

Molecular Properties

Compound Name3-chloro-N-(1-cyclobutylethyl)-2-methyl-5-sulfamoylbenzamide
PubChem CID107101061
Molecular FormulaC14H19ClN2O3S
Molecular Weight330.84 g/mol
Exact Mass330.08
IUPAC Name3-chloro-N-(1-cyclobutylethyl)-2-methyl-5-sulfamoylbenzamide
SMILESCc1c(Cl)cc(S(N)(=O)=O)cc1C(=O)NC(C)C1CCC1
InChIInChI=1S/C14H19ClN2O3S/c1-8-12(6-11(7-13(8)15)21(16,19)20)14(18)17-9(2)10-4-3-5-10/h6-7,9-10H,3-5H2,1-2H3,(H,17,18)(H2,16,19,20)
InChIKeySWPIGVCXNZZOAU-UHFFFAOYSA-N
XLogP2.21
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.84
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-chloro-N-(1-cyclobutylethyl)-2-methyl-5-sulfamoylbenzamide 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

N-(1-cyclopropylethyl)-2,3-dimethyl-5-sulfamoylbenzamide
CID 65389131
2-bromo-N-(1-cyclobutylethyl)-5-sulfamoylbenzamide
CID 115769124
N-(1-cyclobutylethyl)-2-methoxy-5-sulfamoylbenzamide
CID 115769101
3-chloro-2-methyl-N-(1-methylsulfinylpropan-2-yl)-5-sulfamoylbenzamide
CID 107101053
3-chloro-2-methyl-N-(oxan-3-yl)-5-sulfamoylbenzamide
CID 107100983
3-amino-5-bromo-N-(1-cyclobutylethyl)-2-methylbenzamide
CID 107873151
N-(1-cyclobutylethyl)-3,4-dimethyl-5-sulfamoylbenzamide
CID 115769138
3-chloro-N-(1-ethylcyclobutyl)-2-methyl-5-sulfamoylbenzamide
CID 107101056
3-chloro-N-(3-cyclopropylpropyl)-2-methyl-5-sulfamoylbenzamide
CID 107101066
3-chloro-2-methyl-N-(2-methylsulfonylethyl)-5-sulfamoylbenzamide
CID 107100939
3-chloro-2-methyl-5-sulfamoylbenzamide
CID 107100898
5-chloro-3-(1-cyclopropylethylcarbamoyl)-2-methylbenzenesulfonyl chloride
CID 82890365

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-(1-cyclobutylethyl)-2-methyl-5-sulfamoylbenzamide?
The IUPAC name of 3-chloro-N-(1-cyclobutylethyl)-2-methyl-5-sulfamoylbenzamide (CID 107101061) is 3-chloro-N-(1-cyclobutylethyl)-2-methyl-5-sulfamoylbenzamide.
What is the SMILES notation for 3-chloro-N-(1-cyclobutylethyl)-2-methyl-5-sulfamoylbenzamide?
The canonical SMILES for 3-chloro-N-(1-cyclobutylethyl)-2-methyl-5-sulfamoylbenzamide is Cc1c(Cl)cc(S(N)(=O)=O)cc1C(=O)NC(C)C1CCC1.
What is the InChIKey of 3-chloro-N-(1-cyclobutylethyl)-2-methyl-5-sulfamoylbenzamide?
The InChIKey is SWPIGVCXNZZOAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O3S/c1-8-12(6-11(7-13(8)15)21(16,19)20)14(18)17-9(2)10-4-3-5-10/h6-7,9-10H,3-5H2,1-2H3,(H,17,18)(H2,16,19,20).
What are the key properties of 3-chloro-N-(1-cyclobutylethyl)-2-methyl-5-sulfamoylbenzamide?
3-chloro-N-(1-cyclobutylethyl)-2-methyl-5-sulfamoylbenzamide has a molecular weight of 330.84 g/mol, XLogP of 2.21, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-(1-cyclobutylethyl)-2-methyl-5-sulfamoylbenzamide is sourced from PubChem (CID 107101061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).