N-(4-methoxyphenyl)-4-[methyl-(4-methylphenyl)sulfonylamino]butanamide

C19H24N2O4S — CID 4639063

IUPACN-(4-methoxyphenyl)-4-[methyl-(4-methylphenyl)sulfonylamino]butanamide
SMILESCOc1ccc(NC(=O)CCCN(C)S(=O)(=O)c2ccc(C)cc2)cc1
InChIInChI=1S/C19H24N2O4S/c1-15-6-12-18(13-7-15)26(23,24)21(2)14-4-5-19(22)20-16-8-10-17(25-3)11-9-16/h6-13H,4-5,14H2,1-3H3,(H,20,22)
InChIKeyNXJRBWYDUICHIR-UHFFFAOYSA-N
MW376.48 g/mol
LogP3.04
Rot. Bonds8

About N-(4-methoxyphenyl)-4-[methyl-(4-methylphenyl)sulfonylamino]butanamide

N-(4-methoxyphenyl)-4-[methyl-(4-methylphenyl)sulfonylamino]butanamide (PubChem CID 4639063) has the molecular formula C19H24N2O4S and a molecular weight of 376.48 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-4-[methyl-(4-methylphenyl)sulfonylamino]butanamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-4-[methyl-(4-methylphenyl)sulfonylamino]butanamide
PubChem CID4639063
Molecular FormulaC19H24N2O4S
Molecular Weight376.48 g/mol
Exact Mass376.15
IUPAC NameN-(4-methoxyphenyl)-4-[methyl-(4-methylphenyl)sulfonylamino]butanamide
SMILESCOc1ccc(NC(=O)CCCN(C)S(=O)(=O)c2ccc(C)cc2)cc1
InChIInChI=1S/C19H24N2O4S/c1-15-6-12-18(13-7-15)26(23,24)21(2)14-4-5-19(22)20-16-8-10-17(25-3)11-9-16/h6-13H,4-5,14H2,1-3H3,(H,20,22)
InChIKeyNXJRBWYDUICHIR-UHFFFAOYSA-N
XLogP3.04
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.48
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(4-methoxyphenyl)-4-[methyl-(4-methylphenyl)sulfonylamino]butanamide 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-(4-methoxyphenyl)-4-[methyl-(4-methylphenyl)sulfonylamino]butanamide?
The IUPAC name of N-(4-methoxyphenyl)-4-[methyl-(4-methylphenyl)sulfonylamino]butanamide (CID 4639063) is N-(4-methoxyphenyl)-4-[methyl-(4-methylphenyl)sulfonylamino]butanamide.
What is the SMILES notation for N-(4-methoxyphenyl)-4-[methyl-(4-methylphenyl)sulfonylamino]butanamide?
The canonical SMILES for N-(4-methoxyphenyl)-4-[methyl-(4-methylphenyl)sulfonylamino]butanamide is COc1ccc(NC(=O)CCCN(C)S(=O)(=O)c2ccc(C)cc2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-4-[methyl-(4-methylphenyl)sulfonylamino]butanamide?
The InChIKey is NXJRBWYDUICHIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4S/c1-15-6-12-18(13-7-15)26(23,24)21(2)14-4-5-19(22)20-16-8-10-17(25-3)11-9-16/h6-13H,4-5,14H2,1-3H3,(H,20,22).
What are the key properties of N-(4-methoxyphenyl)-4-[methyl-(4-methylphenyl)sulfonylamino]butanamide?
N-(4-methoxyphenyl)-4-[methyl-(4-methylphenyl)sulfonylamino]butanamide has a molecular weight of 376.48 g/mol, XLogP of 3.04, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-4-[methyl-(4-methylphenyl)sulfonylamino]butanamide is sourced from PubChem (CID 4639063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).