2-[(4-methoxy-2-methyl-5-propan-2-ylphenyl)sulfonylamino]benzamide

C18H22N2O4S — CID 91824621

IUPAC2-[(4-methoxy-2-methyl-5-propan-2-ylphenyl)sulfonylamino]benzamide
SMILESCOc1cc(C)c(S(=O)(=O)Nc2ccccc2C(N)=O)cc1C(C)C
InChIInChI=1S/C18H22N2O4S/c1-11(2)14-10-17(12(3)9-16(14)24-4)25(22,23)20-15-8-6-5-7-13(15)18(19)21/h5-11,20H,1-4H3,(H2,19,21)
InChIKeyIIJAOZQEYKQRIG-UHFFFAOYSA-N
MW362.45 g/mol
LogP3.03
Rot. Bonds6

About 2-[(4-methoxy-2-methyl-5-propan-2-ylphenyl)sulfonylamino]benzamide

2-[(4-methoxy-2-methyl-5-propan-2-ylphenyl)sulfonylamino]benzamide (PubChem CID 91824621) has the molecular formula C18H22N2O4S and a molecular weight of 362.45 g/mol. Its IUPAC name is 2-[(4-methoxy-2-methyl-5-propan-2-ylphenyl)sulfonylamino]benzamide.

Molecular Properties

Compound Name2-[(4-methoxy-2-methyl-5-propan-2-ylphenyl)sulfonylamino]benzamide
PubChem CID91824621
Molecular FormulaC18H22N2O4S
Molecular Weight362.45 g/mol
Exact Mass362.13
IUPAC Name2-[(4-methoxy-2-methyl-5-propan-2-ylphenyl)sulfonylamino]benzamide
SMILESCOc1cc(C)c(S(=O)(=O)Nc2ccccc2C(N)=O)cc1C(C)C
InChIInChI=1S/C18H22N2O4S/c1-11(2)14-10-17(12(3)9-16(14)24-4)25(22,23)20-15-8-6-5-7-13(15)18(19)21/h5-11,20H,1-4H3,(H2,19,21)
InChIKeyIIJAOZQEYKQRIG-UHFFFAOYSA-N
XLogP3.03
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.45
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[(4-methoxy-2-methyl-5-propan-2-ylphenyl)sulfonylamino]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(5-methoxy-2,4-dimethylphenyl)sulfonylamino]benzamide
CID 91824586
2-[(4-methoxy-2-methyl-5-propan-2-ylphenyl)sulfonylamino]-N-(3-methoxypropyl)benzamide
CID 100545095
2-[(2-methoxy-5-propan-2-ylphenyl)sulfonylamino]benzamide
CID 91824572
methyl 4,5-dimethoxy-2-[(4-methoxy-2-methyl-5-propan-2-ylphenyl)sulfonylamino]benzoate
CID 100508887
2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]-N-propan-2-ylbenzamide
CID 94619748
4-methoxy-2-methyl-5-propan-2-yl-N-pyridin-2-ylbenzenesulfonamide
CID 2986032
methyl 2-[(2-methoxy-4,5-dimethylphenyl)sulfonylamino]benzoate
CID 27242666
2-[(5-bromo-2-methylphenyl)sulfonylamino]benzamide
CID 17412326
(2R)-2-[(4-methoxy-2-methyl-5-propan-2-ylphenyl)sulfonylamino]-2-phenylacetic acid
CID 122069465
N-[1-(3,4-dimethylphenyl)ethyl]-4-methoxy-2-methyl-5-propan-2-ylbenzenesulfonamide
CID 133162278
3-[(2-methoxyphenyl)sulfonylamino]-2-methylbenzamide
CID 86983204
4-methoxy-2-methyl-N-[(1R)-1-(2-methylphenyl)ethyl]-5-propan-2-ylbenzenesulfonamide
CID 100647223

Frequently Asked Questions

What is the IUPAC name of 2-[(4-methoxy-2-methyl-5-propan-2-ylphenyl)sulfonylamino]benzamide?
The IUPAC name of 2-[(4-methoxy-2-methyl-5-propan-2-ylphenyl)sulfonylamino]benzamide (CID 91824621) is 2-[(4-methoxy-2-methyl-5-propan-2-ylphenyl)sulfonylamino]benzamide.
What is the SMILES notation for 2-[(4-methoxy-2-methyl-5-propan-2-ylphenyl)sulfonylamino]benzamide?
The canonical SMILES for 2-[(4-methoxy-2-methyl-5-propan-2-ylphenyl)sulfonylamino]benzamide is COc1cc(C)c(S(=O)(=O)Nc2ccccc2C(N)=O)cc1C(C)C.
What is the InChIKey of 2-[(4-methoxy-2-methyl-5-propan-2-ylphenyl)sulfonylamino]benzamide?
The InChIKey is IIJAOZQEYKQRIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O4S/c1-11(2)14-10-17(12(3)9-16(14)24-4)25(22,23)20-15-8-6-5-7-13(15)18(19)21/h5-11,20H,1-4H3,(H2,19,21).
What are the key properties of 2-[(4-methoxy-2-methyl-5-propan-2-ylphenyl)sulfonylamino]benzamide?
2-[(4-methoxy-2-methyl-5-propan-2-ylphenyl)sulfonylamino]benzamide has a molecular weight of 362.45 g/mol, XLogP of 3.03, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-methoxy-2-methyl-5-propan-2-ylphenyl)sulfonylamino]benzamide is sourced from PubChem (CID 91824621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).