N-(4-chlorophenyl)-2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]acetamide

C17H19ClN2O4S — CID 112997944

IUPACN-(4-chlorophenyl)-2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]acetamide
SMILESCOc1cc(C)c(S(=O)(=O)NCC(=O)Nc2ccc(Cl)cc2)cc1C
InChIInChI=1S/C17H19ClN2O4S/c1-11-9-16(12(2)8-15(11)24-3)25(22,23)19-10-17(21)20-14-6-4-13(18)5-7-14/h4-9,19H,10H2,1-3H3,(H,20,21)
InChIKeyZIOQQYUYPVGXLM-UHFFFAOYSA-N
MW382.87 g/mol
LogP2.88
Rot. Bonds6

About N-(4-chlorophenyl)-2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]acetamide

N-(4-chlorophenyl)-2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]acetamide (PubChem CID 112997944) has the molecular formula C17H19ClN2O4S and a molecular weight of 382.87 g/mol. Its IUPAC name is N-(4-chlorophenyl)-2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]acetamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]acetamide
PubChem CID112997944
Molecular FormulaC17H19ClN2O4S
Molecular Weight382.87 g/mol
Exact Mass382.08
IUPAC NameN-(4-chlorophenyl)-2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]acetamide
SMILESCOc1cc(C)c(S(=O)(=O)NCC(=O)Nc2ccc(Cl)cc2)cc1C
InChIInChI=1S/C17H19ClN2O4S/c1-11-9-16(12(2)8-15(11)24-3)25(22,23)19-10-17(21)20-14-6-4-13(18)5-7-14/h4-9,19H,10H2,1-3H3,(H,20,21)
InChIKeyZIOQQYUYPVGXLM-UHFFFAOYSA-N
XLogP2.88
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.87
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(4-chlorophenyl)-2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]acetamide 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-chlorophenyl)-2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]acetamide?
The IUPAC name of N-(4-chlorophenyl)-2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]acetamide (CID 112997944) is N-(4-chlorophenyl)-2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]acetamide.
What is the SMILES notation for N-(4-chlorophenyl)-2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]acetamide?
The canonical SMILES for N-(4-chlorophenyl)-2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]acetamide is COc1cc(C)c(S(=O)(=O)NCC(=O)Nc2ccc(Cl)cc2)cc1C.
What is the InChIKey of N-(4-chlorophenyl)-2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]acetamide?
The InChIKey is ZIOQQYUYPVGXLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19ClN2O4S/c1-11-9-16(12(2)8-15(11)24-3)25(22,23)19-10-17(21)20-14-6-4-13(18)5-7-14/h4-9,19H,10H2,1-3H3,(H,20,21).
What are the key properties of N-(4-chlorophenyl)-2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]acetamide?
N-(4-chlorophenyl)-2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]acetamide has a molecular weight of 382.87 g/mol, XLogP of 2.88, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]acetamide is sourced from PubChem (CID 112997944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).