N-butan-2-yl-5-[(4-methoxyphenyl)sulfamoyl]-2-methylbenzamide

C19H24N2O4S — CID 51160733

IUPACN-butan-2-yl-5-[(4-methoxyphenyl)sulfamoyl]-2-methylbenzamide
SMILESCCC(C)NC(=O)c1cc(S(=O)(=O)Nc2ccc(OC)cc2)ccc1C
InChIInChI=1S/C19H24N2O4S/c1-5-14(3)20-19(22)18-12-17(11-6-13(18)2)26(23,24)21-15-7-9-16(25-4)10-8-15/h6-12,14,21H,5H2,1-4H3,(H,20,22)
InChIKeyWIRTUUVVPKWBOC-UHFFFAOYSA-N
MW376.48 g/mol
LogP3.33
Rot. Bonds7

About N-butan-2-yl-5-[(4-methoxyphenyl)sulfamoyl]-2-methylbenzamide

N-butan-2-yl-5-[(4-methoxyphenyl)sulfamoyl]-2-methylbenzamide (PubChem CID 51160733) has the molecular formula C19H24N2O4S and a molecular weight of 376.48 g/mol. Its IUPAC name is N-butan-2-yl-5-[(4-methoxyphenyl)sulfamoyl]-2-methylbenzamide.

Molecular Properties

Compound NameN-butan-2-yl-5-[(4-methoxyphenyl)sulfamoyl]-2-methylbenzamide
PubChem CID51160733
Molecular FormulaC19H24N2O4S
Molecular Weight376.48 g/mol
Exact Mass376.15
IUPAC NameN-butan-2-yl-5-[(4-methoxyphenyl)sulfamoyl]-2-methylbenzamide
SMILESCCC(C)NC(=O)c1cc(S(=O)(=O)Nc2ccc(OC)cc2)ccc1C
InChIInChI=1S/C19H24N2O4S/c1-5-14(3)20-19(22)18-12-17(11-6-13(18)2)26(23,24)21-15-7-9-16(25-4)10-8-15/h6-12,14,21H,5H2,1-4H3,(H,20,22)
InChIKeyWIRTUUVVPKWBOC-UHFFFAOYSA-N
XLogP3.33
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.48
LogP ≤ 53.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-butan-2-yl-5-[(4-methoxyphenyl)sulfamoyl]-2-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 N-butan-2-yl-5-[(4-methoxyphenyl)sulfamoyl]-2-methylbenzamide?
The IUPAC name of N-butan-2-yl-5-[(4-methoxyphenyl)sulfamoyl]-2-methylbenzamide (CID 51160733) is N-butan-2-yl-5-[(4-methoxyphenyl)sulfamoyl]-2-methylbenzamide.
What is the SMILES notation for N-butan-2-yl-5-[(4-methoxyphenyl)sulfamoyl]-2-methylbenzamide?
The canonical SMILES for N-butan-2-yl-5-[(4-methoxyphenyl)sulfamoyl]-2-methylbenzamide is CCC(C)NC(=O)c1cc(S(=O)(=O)Nc2ccc(OC)cc2)ccc1C.
What is the InChIKey of N-butan-2-yl-5-[(4-methoxyphenyl)sulfamoyl]-2-methylbenzamide?
The InChIKey is WIRTUUVVPKWBOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4S/c1-5-14(3)20-19(22)18-12-17(11-6-13(18)2)26(23,24)21-15-7-9-16(25-4)10-8-15/h6-12,14,21H,5H2,1-4H3,(H,20,22).
What are the key properties of N-butan-2-yl-5-[(4-methoxyphenyl)sulfamoyl]-2-methylbenzamide?
N-butan-2-yl-5-[(4-methoxyphenyl)sulfamoyl]-2-methylbenzamide has a molecular weight of 376.48 g/mol, XLogP of 3.33, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-5-[(4-methoxyphenyl)sulfamoyl]-2-methylbenzamide is sourced from PubChem (CID 51160733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).