2-[(2,4-dimethylphenyl)sulfonylamino]-N-(2-methylphenyl)acetamide

C17H20N2O3S — CID 112996080

IUPAC2-[(2,4-dimethylphenyl)sulfonylamino]-N-(2-methylphenyl)acetamide
SMILESCc1ccc(S(=O)(=O)NCC(=O)Nc2ccccc2C)c(C)c1
InChIInChI=1S/C17H20N2O3S/c1-12-8-9-16(14(3)10-12)23(21,22)18-11-17(20)19-15-7-5-4-6-13(15)2/h4-10,18H,11H2,1-3H3,(H,19,20)
InChIKeyWENIVIJJIOTHKW-UHFFFAOYSA-N
MW332.43 g/mol
LogP2.53
Rot. Bonds5

About 2-[(2,4-dimethylphenyl)sulfonylamino]-N-(2-methylphenyl)acetamide

2-[(2,4-dimethylphenyl)sulfonylamino]-N-(2-methylphenyl)acetamide (PubChem CID 112996080) has the molecular formula C17H20N2O3S and a molecular weight of 332.43 g/mol. Its IUPAC name is 2-[(2,4-dimethylphenyl)sulfonylamino]-N-(2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[(2,4-dimethylphenyl)sulfonylamino]-N-(2-methylphenyl)acetamide
PubChem CID112996080
Molecular FormulaC17H20N2O3S
Molecular Weight332.43 g/mol
Exact Mass332.12
IUPAC Name2-[(2,4-dimethylphenyl)sulfonylamino]-N-(2-methylphenyl)acetamide
SMILESCc1ccc(S(=O)(=O)NCC(=O)Nc2ccccc2C)c(C)c1
InChIInChI=1S/C17H20N2O3S/c1-12-8-9-16(14(3)10-12)23(21,22)18-11-17(20)19-15-7-5-4-6-13(15)2/h4-10,18H,11H2,1-3H3,(H,19,20)
InChIKeyWENIVIJJIOTHKW-UHFFFAOYSA-N
XLogP2.53
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.43
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(2,4-dimethylphenyl)sulfonylamino]-N-(2-methylphenyl)acetamide?
The IUPAC name of 2-[(2,4-dimethylphenyl)sulfonylamino]-N-(2-methylphenyl)acetamide (CID 112996080) is 2-[(2,4-dimethylphenyl)sulfonylamino]-N-(2-methylphenyl)acetamide.
What is the SMILES notation for 2-[(2,4-dimethylphenyl)sulfonylamino]-N-(2-methylphenyl)acetamide?
The canonical SMILES for 2-[(2,4-dimethylphenyl)sulfonylamino]-N-(2-methylphenyl)acetamide is Cc1ccc(S(=O)(=O)NCC(=O)Nc2ccccc2C)c(C)c1.
What is the InChIKey of 2-[(2,4-dimethylphenyl)sulfonylamino]-N-(2-methylphenyl)acetamide?
The InChIKey is WENIVIJJIOTHKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3S/c1-12-8-9-16(14(3)10-12)23(21,22)18-11-17(20)19-15-7-5-4-6-13(15)2/h4-10,18H,11H2,1-3H3,(H,19,20).
What are the key properties of 2-[(2,4-dimethylphenyl)sulfonylamino]-N-(2-methylphenyl)acetamide?
2-[(2,4-dimethylphenyl)sulfonylamino]-N-(2-methylphenyl)acetamide has a molecular weight of 332.43 g/mol, XLogP of 2.53, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,4-dimethylphenyl)sulfonylamino]-N-(2-methylphenyl)acetamide is sourced from PubChem (CID 112996080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).