4-[cyclohexyl(methyl)sulfamoyl]-N-[[4-(dimethylamino)phenyl]methyl]-N-methylbenzamide

C24H33N3O3S — CID 27861404

IUPAC4-[cyclohexyl(methyl)sulfamoyl]-N-[[4-(dimethylamino)phenyl]methyl]-N-methylbenzamide
SMILESCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1
InChIInChI=1S/C24H33N3O3S/c1-25(2)21-14-10-19(11-15-21)18-26(3)24(28)20-12-16-23(17-13-20)31(29,30)27(4)22-8-6-5-7-9-22/h10-17,22H,5-9,18H2,1-4H3
InChIKeyIOYMAUSDOUTGOM-UHFFFAOYSA-N
MW443.61 g/mol
LogP3.98
Rot. Bonds7

About 4-[cyclohexyl(methyl)sulfamoyl]-N-[[4-(dimethylamino)phenyl]methyl]-N-methylbenzamide

4-[cyclohexyl(methyl)sulfamoyl]-N-[[4-(dimethylamino)phenyl]methyl]-N-methylbenzamide (PubChem CID 27861404) has the molecular formula C24H33N3O3S and a molecular weight of 443.61 g/mol. Its IUPAC name is 4-[cyclohexyl(methyl)sulfamoyl]-N-[[4-(dimethylamino)phenyl]methyl]-N-methylbenzamide.

Molecular Properties

Compound Name4-[cyclohexyl(methyl)sulfamoyl]-N-[[4-(dimethylamino)phenyl]methyl]-N-methylbenzamide
PubChem CID27861404
Molecular FormulaC24H33N3O3S
Molecular Weight443.61 g/mol
Exact Mass443.22
IUPAC Name4-[cyclohexyl(methyl)sulfamoyl]-N-[[4-(dimethylamino)phenyl]methyl]-N-methylbenzamide
SMILESCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1
InChIInChI=1S/C24H33N3O3S/c1-25(2)21-14-10-19(11-15-21)18-26(3)24(28)20-12-16-23(17-13-20)31(29,30)27(4)22-8-6-5-7-9-22/h10-17,22H,5-9,18H2,1-4H3
InChIKeyIOYMAUSDOUTGOM-UHFFFAOYSA-N
XLogP3.98
TPSA60.93 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500443.61
LogP ≤ 53.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_D(198)', 'substructure': 'N/A'}, {'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

Analyze 4-[cyclohexyl(methyl)sulfamoyl]-N-[[4-(dimethylamino)phenyl]methyl]-N-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

4-[cyclohexyl(methyl)sulfamoyl]-N-cyclopentyl-N-ethylbenzamide
CID 134060936
4-[[[4-[cyclohexyl(methyl)sulfamoyl]benzoyl]-cyclopropylamino]methyl]benzamide
CID 38371562
4-[cyclohexyl(methyl)sulfamoyl]-N-methyl-N-[(5-methylfuran-2-yl)methyl]benzamide
CID 46654097
N-[[4-(dimethylamino)phenyl]methyl]-N-methyl-4-(trifluoromethylsulfonyl)benzamide
CID 35746005
4-[cyclopentyl(methyl)sulfamoyl]benzoic acid
CID 43213257
3-[cyclohexyl(methyl)sulfamoyl]-N-methyl-N-(thiophen-3-ylmethyl)benzamide
CID 43017747
methyl 4-[cyclohexyl(methyl)sulfamoyl]benzoate
CID 26526871
N-(2-amino-2-oxoethyl)-4-[[[4-[cyclohexyl(methyl)sulfamoyl]benzoyl]amino]methyl]benzamide
CID 46494457
4-[cyclohexyl(methyl)sulfamoyl]-N-[[4-(2-methoxyethoxy)phenyl]methyl]benzamide
CID 46485483
N-(2-aminoethyl)-4-[cyclohexyl(methyl)sulfamoyl]benzamide;hydrochloride
CID 119384031
N-[[4-(dimethylamino)phenyl]methyl]-4-(2-methoxyethylsulfamoyl)-N-methylbenzamide
CID 35805338
N-[2-(cyclohexanecarbonylamino)ethyl]-4-[cyclohexyl(methyl)sulfamoyl]benzamide
CID 55805978

Frequently Asked Questions

What is the IUPAC name of 4-[cyclohexyl(methyl)sulfamoyl]-N-[[4-(dimethylamino)phenyl]methyl]-N-methylbenzamide?
The IUPAC name of 4-[cyclohexyl(methyl)sulfamoyl]-N-[[4-(dimethylamino)phenyl]methyl]-N-methylbenzamide (CID 27861404) is 4-[cyclohexyl(methyl)sulfamoyl]-N-[[4-(dimethylamino)phenyl]methyl]-N-methylbenzamide.
What is the SMILES notation for 4-[cyclohexyl(methyl)sulfamoyl]-N-[[4-(dimethylamino)phenyl]methyl]-N-methylbenzamide?
The canonical SMILES for 4-[cyclohexyl(methyl)sulfamoyl]-N-[[4-(dimethylamino)phenyl]methyl]-N-methylbenzamide is CN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1.
What is the InChIKey of 4-[cyclohexyl(methyl)sulfamoyl]-N-[[4-(dimethylamino)phenyl]methyl]-N-methylbenzamide?
The InChIKey is IOYMAUSDOUTGOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H33N3O3S/c1-25(2)21-14-10-19(11-15-21)18-26(3)24(28)20-12-16-23(17-13-20)31(29,30)27(4)22-8-6-5-7-9-22/h10-17,22H,5-9,18H2,1-4H3.
What are the key properties of 4-[cyclohexyl(methyl)sulfamoyl]-N-[[4-(dimethylamino)phenyl]methyl]-N-methylbenzamide?
4-[cyclohexyl(methyl)sulfamoyl]-N-[[4-(dimethylamino)phenyl]methyl]-N-methylbenzamide has a molecular weight of 443.61 g/mol, XLogP of 3.98, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[cyclohexyl(methyl)sulfamoyl]-N-[[4-(dimethylamino)phenyl]methyl]-N-methylbenzamide is sourced from PubChem (CID 27861404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).