2-[(2,5-dimethylphenyl)sulfonylamino]-N-(2-methoxyethyl)benzamide

C18H22N2O4S — CID 35990783

IUPAC2-[(2,5-dimethylphenyl)sulfonylamino]-N-(2-methoxyethyl)benzamide
SMILESCOCCNC(=O)c1ccccc1NS(=O)(=O)c1cc(C)ccc1C
InChIInChI=1S/C18H22N2O4S/c1-13-8-9-14(2)17(12-13)25(22,23)20-16-7-5-4-6-15(16)18(21)19-10-11-24-3/h4-9,12,20H,10-11H2,1-3H3,(H,19,21)
InChIKeyZPNZDFVDRXPGMN-UHFFFAOYSA-N
MW362.45 g/mol
LogP2.48
Rot. Bonds7

About 2-[(2,5-dimethylphenyl)sulfonylamino]-N-(2-methoxyethyl)benzamide

2-[(2,5-dimethylphenyl)sulfonylamino]-N-(2-methoxyethyl)benzamide (PubChem CID 35990783) has the molecular formula C18H22N2O4S and a molecular weight of 362.45 g/mol. Its IUPAC name is 2-[(2,5-dimethylphenyl)sulfonylamino]-N-(2-methoxyethyl)benzamide.

Molecular Properties

Compound Name2-[(2,5-dimethylphenyl)sulfonylamino]-N-(2-methoxyethyl)benzamide
PubChem CID35990783
Molecular FormulaC18H22N2O4S
Molecular Weight362.45 g/mol
Exact Mass362.13
IUPAC Name2-[(2,5-dimethylphenyl)sulfonylamino]-N-(2-methoxyethyl)benzamide
SMILESCOCCNC(=O)c1ccccc1NS(=O)(=O)c1cc(C)ccc1C
InChIInChI=1S/C18H22N2O4S/c1-13-8-9-14(2)17(12-13)25(22,23)20-16-7-5-4-6-15(16)18(21)19-10-11-24-3/h4-9,12,20H,10-11H2,1-3H3,(H,19,21)
InChIKeyZPNZDFVDRXPGMN-UHFFFAOYSA-N
XLogP2.48
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.45
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[(2,5-dimethylphenyl)sulfonylamino]-N-[2-[(4-methoxybenzoyl)amino]ethyl]benzamide
CID 55959451
2-[(2,5-dimethylphenyl)sulfonylamino]-N-(2-thiophen-2-ylethyl)benzamide
CID 35990962
N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-[(2,5-dimethylphenyl)sulfonylamino]benzamide
CID 112770794
2-[(2,5-dimethylphenyl)sulfonylamino]-N-(pyridin-3-ylmethyl)benzamide
CID 29238976
2-(ethylsulfonylamino)-N-(2-methoxyethyl)benzamide
CID 47141588
N-(3,5-dichlorophenyl)-2-[(2,5-dimethylphenyl)sulfonylamino]benzamide
CID 2333532
2-[(4-methoxy-2-methyl-5-propan-2-ylphenyl)sulfonylamino]-N-(3-methoxypropyl)benzamide
CID 100545095
2-[[2-(methanesulfonamido)benzoyl]amino]-N-(2-methoxyethyl)benzamide
CID 2230013
3-[(2,4-dimethylphenyl)sulfamoyl]-4-methyl-N-[2-(propylcarbamoyl)phenyl]benzamide
CID 4303867
2-[(2-methyl-5-nitrophenyl)sulfonylamino]-N-propylbenzamide
CID 40690037
N-[2-(2-methoxyethylcarbamoyl)phenyl]-3,4-dimethylbenzamide
CID 100592155
2-(benzenesulfonamido)-N-(3-methoxypropyl)benzamide
CID 2967457

Frequently Asked Questions

What is the IUPAC name of 2-[(2,5-dimethylphenyl)sulfonylamino]-N-(2-methoxyethyl)benzamide?
The IUPAC name of 2-[(2,5-dimethylphenyl)sulfonylamino]-N-(2-methoxyethyl)benzamide (CID 35990783) is 2-[(2,5-dimethylphenyl)sulfonylamino]-N-(2-methoxyethyl)benzamide.
What is the SMILES notation for 2-[(2,5-dimethylphenyl)sulfonylamino]-N-(2-methoxyethyl)benzamide?
The canonical SMILES for 2-[(2,5-dimethylphenyl)sulfonylamino]-N-(2-methoxyethyl)benzamide is COCCNC(=O)c1ccccc1NS(=O)(=O)c1cc(C)ccc1C.
What is the InChIKey of 2-[(2,5-dimethylphenyl)sulfonylamino]-N-(2-methoxyethyl)benzamide?
The InChIKey is ZPNZDFVDRXPGMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O4S/c1-13-8-9-14(2)17(12-13)25(22,23)20-16-7-5-4-6-15(16)18(21)19-10-11-24-3/h4-9,12,20H,10-11H2,1-3H3,(H,19,21).
What are the key properties of 2-[(2,5-dimethylphenyl)sulfonylamino]-N-(2-methoxyethyl)benzamide?
2-[(2,5-dimethylphenyl)sulfonylamino]-N-(2-methoxyethyl)benzamide has a molecular weight of 362.45 g/mol, XLogP of 2.48, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,5-dimethylphenyl)sulfonylamino]-N-(2-methoxyethyl)benzamide is sourced from PubChem (CID 35990783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).