N-[[4-(2-methoxyethylsulfamoyl)phenyl]methyl]-4-methylbenzamide

C18H22N2O4S — CID 108758979

IUPACN-[[4-(2-methoxyethylsulfamoyl)phenyl]methyl]-4-methylbenzamide
SMILESCOCCNS(=O)(=O)c1ccc(CNC(=O)c2ccc(C)cc2)cc1
InChIInChI=1S/C18H22N2O4S/c1-14-3-7-16(8-4-14)18(21)19-13-15-5-9-17(10-6-15)25(22,23)20-11-12-24-2/h3-10,20H,11-13H2,1-2H3,(H,19,21)
InChIKeyLIARCHAULRGZJA-UHFFFAOYSA-N
MW362.45 g/mol
LogP1.85
Rot. Bonds8

About N-[[4-(2-methoxyethylsulfamoyl)phenyl]methyl]-4-methylbenzamide

N-[[4-(2-methoxyethylsulfamoyl)phenyl]methyl]-4-methylbenzamide (PubChem CID 108758979) has the molecular formula C18H22N2O4S and a molecular weight of 362.45 g/mol. Its IUPAC name is N-[[4-(2-methoxyethylsulfamoyl)phenyl]methyl]-4-methylbenzamide.

Molecular Properties

Compound NameN-[[4-(2-methoxyethylsulfamoyl)phenyl]methyl]-4-methylbenzamide
PubChem CID108758979
Molecular FormulaC18H22N2O4S
Molecular Weight362.45 g/mol
Exact Mass362.13
IUPAC NameN-[[4-(2-methoxyethylsulfamoyl)phenyl]methyl]-4-methylbenzamide
SMILESCOCCNS(=O)(=O)c1ccc(CNC(=O)c2ccc(C)cc2)cc1
InChIInChI=1S/C18H22N2O4S/c1-14-3-7-16(8-4-14)18(21)19-13-15-5-9-17(10-6-15)25(22,23)20-11-12-24-2/h3-10,20H,11-13H2,1-2H3,(H,19,21)
InChIKeyLIARCHAULRGZJA-UHFFFAOYSA-N
XLogP1.85
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.45
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-[[4-(2-methoxyethylsulfamoyl)phenyl]methyl]-4-methylbenzamide 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

N-(3-methoxypropyl)-4-[(4-methylphenyl)methylsulfamoyl]benzamide
CID 109059815
methyl N-[[4-(2-methoxyethylsulfamoyl)phenyl]methyl]carbamate
CID 108735953
N-[[4-(2-methoxyethylsulfamoyl)phenyl]methyl]-2-(4-methylphenoxy)acetamide
CID 108736002
4-hexoxy-N-[[4-(2-methoxyethylsulfamoyl)phenyl]methyl]benzamide
CID 108759021
N-[(4-methoxyphenyl)methyl]-4-(3-methoxypropylsulfamoyl)benzamide
CID 109059892
2-bromo-5-(2-methoxyethylsulfamoyl)-N-[(4-methylphenyl)methyl]benzamide
CID 31541929
N-[[4-(2-methoxyethylsulfamoyl)phenyl]methyl]-4-(4-methylphenoxy)butanamide
CID 108759077
N-[[6-(dimethylamino)-3-pyridinyl]methyl]-4-(2-methoxyethylsulfamoyl)benzamide
CID 55620834
N-(2-methoxyethyl)-4-[[[2-(4-methylanilino)acetyl]amino]carbamoyl]benzenesulfonamide
CID 55490440
1-ethyl-2-[[4-(2-methoxyethylsulfamoyl)phenyl]methyl]-3-[(4-methylphenyl)methyl]guanidine;hydroiodide
CID 111243966
4-butoxy-3-ethoxy-N-[[4-(2-methoxyethylsulfamoyl)phenyl]methyl]benzamide
CID 108759094
4-(2-methoxyethylsulfamoyl)-N-[4-(4-methylphenoxy)phenyl]benzamide
CID 24584227

Frequently Asked Questions

What is the IUPAC name of N-[[4-(2-methoxyethylsulfamoyl)phenyl]methyl]-4-methylbenzamide?
The IUPAC name of N-[[4-(2-methoxyethylsulfamoyl)phenyl]methyl]-4-methylbenzamide (CID 108758979) is N-[[4-(2-methoxyethylsulfamoyl)phenyl]methyl]-4-methylbenzamide.
What is the SMILES notation for N-[[4-(2-methoxyethylsulfamoyl)phenyl]methyl]-4-methylbenzamide?
The canonical SMILES for N-[[4-(2-methoxyethylsulfamoyl)phenyl]methyl]-4-methylbenzamide is COCCNS(=O)(=O)c1ccc(CNC(=O)c2ccc(C)cc2)cc1.
What is the InChIKey of N-[[4-(2-methoxyethylsulfamoyl)phenyl]methyl]-4-methylbenzamide?
The InChIKey is LIARCHAULRGZJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O4S/c1-14-3-7-16(8-4-14)18(21)19-13-15-5-9-17(10-6-15)25(22,23)20-11-12-24-2/h3-10,20H,11-13H2,1-2H3,(H,19,21).
What are the key properties of N-[[4-(2-methoxyethylsulfamoyl)phenyl]methyl]-4-methylbenzamide?
N-[[4-(2-methoxyethylsulfamoyl)phenyl]methyl]-4-methylbenzamide has a molecular weight of 362.45 g/mol, XLogP of 1.85, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(2-methoxyethylsulfamoyl)phenyl]methyl]-4-methylbenzamide is sourced from PubChem (CID 108758979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).