4-(dimethylsulfamoyl)-N-[2-(2-methoxyphenoxy)ethyl]benzamide

C18H22N2O5S — CID 2293105

IUPAC4-(dimethylsulfamoyl)-N-[2-(2-methoxyphenoxy)ethyl]benzamide
SMILESCOc1ccccc1OCCNC(=O)c1ccc(S(=O)(=O)N(C)C)cc1
InChIInChI=1S/C18H22N2O5S/c1-20(2)26(22,23)15-10-8-14(9-11-15)18(21)19-12-13-25-17-7-5-4-6-16(17)24-3/h4-11H,12-13H2,1-3H3,(H,19,21)
InChIKeyBFZVTJRJSDSPET-UHFFFAOYSA-N
MW378.45 g/mol
LogP1.75
Rot. Bonds8

About 4-(dimethylsulfamoyl)-N-[2-(2-methoxyphenoxy)ethyl]benzamide

4-(dimethylsulfamoyl)-N-[2-(2-methoxyphenoxy)ethyl]benzamide (PubChem CID 2293105) has the molecular formula C18H22N2O5S and a molecular weight of 378.45 g/mol. Its IUPAC name is 4-(dimethylsulfamoyl)-N-[2-(2-methoxyphenoxy)ethyl]benzamide.

Molecular Properties

Compound Name4-(dimethylsulfamoyl)-N-[2-(2-methoxyphenoxy)ethyl]benzamide
PubChem CID2293105
Molecular FormulaC18H22N2O5S
Molecular Weight378.45 g/mol
Exact Mass378.12
IUPAC Name4-(dimethylsulfamoyl)-N-[2-(2-methoxyphenoxy)ethyl]benzamide
SMILESCOc1ccccc1OCCNC(=O)c1ccc(S(=O)(=O)N(C)C)cc1
InChIInChI=1S/C18H22N2O5S/c1-20(2)26(22,23)15-10-8-14(9-11-15)18(21)19-12-13-25-17-7-5-4-6-16(17)24-3/h4-11H,12-13H2,1-3H3,(H,19,21)
InChIKeyBFZVTJRJSDSPET-UHFFFAOYSA-N
XLogP1.75
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.45
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

Cyprosulfamide
CID 11707647
4-tert-butyl-N-[2-(2-methoxyphenoxy)ethyl]benzamide
CID 2222870
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CID 21806575
4-Methoxy-3-(3-Methoxypropoxy)-N-{[(3s,4s)-4-{[(4-Methylphenyl)sulfonyl]amino}pyrrolidin-3-Yl]methyl}-N-(Propan-2-Yl)benzamide
CID 91664005
2-(4-methoxyphenyl)-N-(4-sulfamoylbenzyl)acetamide
CID 4578038
4-Dipropylsulfamoyl-N-furan-2-ylmethyl-benzamide
CID 1128083
4-[(2,3-dihydro-1,4-benzodioxine-3-carbonylamino)carbamoyl]-N,N-diethylbenzenesulfonamide
CID 4875542
N-Furan-2-ylmethyl-4-(4-methyl-piperidine-1-sulfonyl)-benzamide
CID 1044182
4-(dimethylsulfamoyl)-N-(2-phenoxyethyl)benzamide
CID 2291802
N-(2-furylmethyl)-4-({[(4-methylphenyl)sulfonyl]amino}methyl)cyclohexanecarboxamide
CID 3239602
4-((N-benzyl-4-ethoxyphenylsulfonamido)methyl)-N-(cyclopropylmethyl)benzamide
CID 44253448
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[4-(prop-2-enoylamino)piperidin-1-yl]sulfonylbenzamide
CID 71449440

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylsulfamoyl)-N-[2-(2-methoxyphenoxy)ethyl]benzamide?
The IUPAC name of 4-(dimethylsulfamoyl)-N-[2-(2-methoxyphenoxy)ethyl]benzamide (CID 2293105) is 4-(dimethylsulfamoyl)-N-[2-(2-methoxyphenoxy)ethyl]benzamide.
What is the SMILES notation for 4-(dimethylsulfamoyl)-N-[2-(2-methoxyphenoxy)ethyl]benzamide?
The canonical SMILES for 4-(dimethylsulfamoyl)-N-[2-(2-methoxyphenoxy)ethyl]benzamide is COc1ccccc1OCCNC(=O)c1ccc(S(=O)(=O)N(C)C)cc1.
What is the InChIKey of 4-(dimethylsulfamoyl)-N-[2-(2-methoxyphenoxy)ethyl]benzamide?
The InChIKey is BFZVTJRJSDSPET-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O5S/c1-20(2)26(22,23)15-10-8-14(9-11-15)18(21)19-12-13-25-17-7-5-4-6-16(17)24-3/h4-11H,12-13H2,1-3H3,(H,19,21).
What are the key properties of 4-(dimethylsulfamoyl)-N-[2-(2-methoxyphenoxy)ethyl]benzamide?
4-(dimethylsulfamoyl)-N-[2-(2-methoxyphenoxy)ethyl]benzamide has a molecular weight of 378.45 g/mol, XLogP of 1.75, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylsulfamoyl)-N-[2-(2-methoxyphenoxy)ethyl]benzamide is sourced from PubChem (CID 2293105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).