4-(cyclopropylsulfamoyl)-N-[(4-ethylphenyl)methyl]-N-methylbenzamide

C20H24N2O3S — CID 18195060

IUPAC4-(cyclopropylsulfamoyl)-N-[(4-ethylphenyl)methyl]-N-methylbenzamide
SMILESCCc1ccc(CN(C)C(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)cc1
InChIInChI=1S/C20H24N2O3S/c1-3-15-4-6-16(7-5-15)14-22(2)20(23)17-8-12-19(13-9-17)26(24,25)21-18-10-11-18/h4-9,12-13,18,21H,3,10-11,14H2,1-2H3
InChIKeyONIUQJSBLLFOSM-UHFFFAOYSA-N
MW372.49 g/mol
LogP2.96
Rot. Bonds7

About 4-(cyclopropylsulfamoyl)-N-[(4-ethylphenyl)methyl]-N-methylbenzamide

4-(cyclopropylsulfamoyl)-N-[(4-ethylphenyl)methyl]-N-methylbenzamide (PubChem CID 18195060) has the molecular formula C20H24N2O3S and a molecular weight of 372.49 g/mol. Its IUPAC name is 4-(cyclopropylsulfamoyl)-N-[(4-ethylphenyl)methyl]-N-methylbenzamide.

Molecular Properties

Compound Name4-(cyclopropylsulfamoyl)-N-[(4-ethylphenyl)methyl]-N-methylbenzamide
PubChem CID18195060
Molecular FormulaC20H24N2O3S
Molecular Weight372.49 g/mol
Exact Mass372.15
IUPAC Name4-(cyclopropylsulfamoyl)-N-[(4-ethylphenyl)methyl]-N-methylbenzamide
SMILESCCc1ccc(CN(C)C(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)cc1
InChIInChI=1S/C20H24N2O3S/c1-3-15-4-6-16(7-5-15)14-22(2)20(23)17-8-12-19(13-9-17)26(24,25)21-18-10-11-18/h4-9,12-13,18,21H,3,10-11,14H2,1-2H3
InChIKeyONIUQJSBLLFOSM-UHFFFAOYSA-N
XLogP2.96
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.49
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(cyclopropylsulfamoyl)-N-[(4-ethylphenyl)methyl]-N-methylbenzamide 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 4-(cyclopropylsulfamoyl)-N-[(4-ethylphenyl)methyl]-N-methylbenzamide?
The IUPAC name of 4-(cyclopropylsulfamoyl)-N-[(4-ethylphenyl)methyl]-N-methylbenzamide (CID 18195060) is 4-(cyclopropylsulfamoyl)-N-[(4-ethylphenyl)methyl]-N-methylbenzamide.
What is the SMILES notation for 4-(cyclopropylsulfamoyl)-N-[(4-ethylphenyl)methyl]-N-methylbenzamide?
The canonical SMILES for 4-(cyclopropylsulfamoyl)-N-[(4-ethylphenyl)methyl]-N-methylbenzamide is CCc1ccc(CN(C)C(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)cc1.
What is the InChIKey of 4-(cyclopropylsulfamoyl)-N-[(4-ethylphenyl)methyl]-N-methylbenzamide?
The InChIKey is ONIUQJSBLLFOSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3S/c1-3-15-4-6-16(7-5-15)14-22(2)20(23)17-8-12-19(13-9-17)26(24,25)21-18-10-11-18/h4-9,12-13,18,21H,3,10-11,14H2,1-2H3.
What are the key properties of 4-(cyclopropylsulfamoyl)-N-[(4-ethylphenyl)methyl]-N-methylbenzamide?
4-(cyclopropylsulfamoyl)-N-[(4-ethylphenyl)methyl]-N-methylbenzamide has a molecular weight of 372.49 g/mol, XLogP of 2.96, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopropylsulfamoyl)-N-[(4-ethylphenyl)methyl]-N-methylbenzamide is sourced from PubChem (CID 18195060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).