N-cyclopropyl-2,4,6-trimethyl-3-sulfamoylbenzamide

C13H18N2O3S — CID 65373441

IUPACN-cyclopropyl-2,4,6-trimethyl-3-sulfamoylbenzamide
SMILESCc1cc(C)c(S(N)(=O)=O)c(C)c1C(=O)NC1CC1
InChIInChI=1S/C13H18N2O3S/c1-7-6-8(2)12(19(14,17)18)9(3)11(7)13(16)15-10-4-5-10/h6,10H,4-5H2,1-3H3,(H,15,16)(H2,14,17,18)
InChIKeyZUAAYRDYLIAXDB-UHFFFAOYSA-N
MW282.37 g/mol
LogP1.15
Rot. Bonds3

About N-cyclopropyl-2,4,6-trimethyl-3-sulfamoylbenzamide

N-cyclopropyl-2,4,6-trimethyl-3-sulfamoylbenzamide (PubChem CID 65373441) has the molecular formula C13H18N2O3S and a molecular weight of 282.37 g/mol. Its IUPAC name is N-cyclopropyl-2,4,6-trimethyl-3-sulfamoylbenzamide.

Molecular Properties

Compound NameN-cyclopropyl-2,4,6-trimethyl-3-sulfamoylbenzamide
PubChem CID65373441
Molecular FormulaC13H18N2O3S
Molecular Weight282.37 g/mol
Exact Mass282.10
IUPAC NameN-cyclopropyl-2,4,6-trimethyl-3-sulfamoylbenzamide
SMILESCc1cc(C)c(S(N)(=O)=O)c(C)c1C(=O)NC1CC1
InChIInChI=1S/C13H18N2O3S/c1-7-6-8(2)12(19(14,17)18)9(3)11(7)13(16)15-10-4-5-10/h6,10H,4-5H2,1-3H3,(H,15,16)(H2,14,17,18)
InChIKeyZUAAYRDYLIAXDB-UHFFFAOYSA-N
XLogP1.15
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.37
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-cyclopropyl-2,4,6-trimethyl-3-sulfamoylbenzamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2,4,6-trimethyl-3-sulfamoylbenzamide?
The IUPAC name of N-cyclopropyl-2,4,6-trimethyl-3-sulfamoylbenzamide (CID 65373441) is N-cyclopropyl-2,4,6-trimethyl-3-sulfamoylbenzamide.
What is the SMILES notation for N-cyclopropyl-2,4,6-trimethyl-3-sulfamoylbenzamide?
The canonical SMILES for N-cyclopropyl-2,4,6-trimethyl-3-sulfamoylbenzamide is Cc1cc(C)c(S(N)(=O)=O)c(C)c1C(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-2,4,6-trimethyl-3-sulfamoylbenzamide?
The InChIKey is ZUAAYRDYLIAXDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O3S/c1-7-6-8(2)12(19(14,17)18)9(3)11(7)13(16)15-10-4-5-10/h6,10H,4-5H2,1-3H3,(H,15,16)(H2,14,17,18).
What are the key properties of N-cyclopropyl-2,4,6-trimethyl-3-sulfamoylbenzamide?
N-cyclopropyl-2,4,6-trimethyl-3-sulfamoylbenzamide has a molecular weight of 282.37 g/mol, XLogP of 1.15, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2,4,6-trimethyl-3-sulfamoylbenzamide is sourced from PubChem (CID 65373441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).