N-(cyclohexylmethyl)-4-[(2-methoxyphenyl)sulfamoyl]-N-methylbenzamide

C22H28N2O4S — CID 43057461

IUPACN-(cyclohexylmethyl)-4-[(2-methoxyphenyl)sulfamoyl]-N-methylbenzamide
SMILESCOc1ccccc1NS(=O)(=O)c1ccc(C(=O)N(C)CC2CCCCC2)cc1
InChIInChI=1S/C22H28N2O4S/c1-24(16-17-8-4-3-5-9-17)22(25)18-12-14-19(15-13-18)29(26,27)23-20-10-6-7-11-21(20)28-2/h6-7,10-15,17,23H,3-5,8-9,16H2,1-2H3
InChIKeyQJFCKXYAMDBKKM-UHFFFAOYSA-N
MW416.54 g/mol
LogP4.15
Rot. Bonds7

About N-(cyclohexylmethyl)-4-[(2-methoxyphenyl)sulfamoyl]-N-methylbenzamide

N-(cyclohexylmethyl)-4-[(2-methoxyphenyl)sulfamoyl]-N-methylbenzamide (PubChem CID 43057461) has the molecular formula C22H28N2O4S and a molecular weight of 416.54 g/mol. Its IUPAC name is N-(cyclohexylmethyl)-4-[(2-methoxyphenyl)sulfamoyl]-N-methylbenzamide.

Molecular Properties

Compound NameN-(cyclohexylmethyl)-4-[(2-methoxyphenyl)sulfamoyl]-N-methylbenzamide
PubChem CID43057461
Molecular FormulaC22H28N2O4S
Molecular Weight416.54 g/mol
Exact Mass416.18
IUPAC NameN-(cyclohexylmethyl)-4-[(2-methoxyphenyl)sulfamoyl]-N-methylbenzamide
SMILESCOc1ccccc1NS(=O)(=O)c1ccc(C(=O)N(C)CC2CCCCC2)cc1
InChIInChI=1S/C22H28N2O4S/c1-24(16-17-8-4-3-5-9-17)22(25)18-12-14-19(15-13-18)29(26,27)23-20-10-6-7-11-21(20)28-2/h6-7,10-15,17,23H,3-5,8-9,16H2,1-2H3
InChIKeyQJFCKXYAMDBKKM-UHFFFAOYSA-N
XLogP4.15
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.54
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(cyclohexylmethyl)-4-[(2-methoxyphenyl)sulfamoyl]-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

N-(cyclohexylmethyl)-2-[(4-fluorophenyl)sulfonylamino]-N-methylbenzamide
CID 39567590
N-[(3,4-dimethoxyphenyl)methyl]-4-[(2-methoxyphenyl)sulfamoyl]-N-methylbenzamide
CID 26594486
N-(2-anilino-2-oxoethyl)-4-[(2-methoxyphenyl)sulfamoyl]-N-methylbenzamide
CID 55637435
4-[(2-methoxyphenyl)sulfamoyl]-N-methyl-N-[(4-methylsulfanylphenyl)methyl]benzamide
CID 26619424
N-[2-(4-chlorophenoxy)ethyl]-4-[(2-methoxyphenyl)sulfamoyl]-N-methylbenzamide
CID 26622481
4-[4-(cyclohexylmethyl)-1,4-diazepane-1-carbonyl]-N-(2-methoxyphenyl)benzenesulfonamide
CID 55956476
N-methyl-N-[(1-methylpiperidin-4-yl)methyl]-4-(phenylsulfamoyl)benzamide
CID 118720903
4-[(2-methoxyphenyl)sulfamoyl]-N-(oxolan-2-ylmethyl)benzamide
CID 46652291
N-(2-methoxyphenyl)-4-(3-methylpiperidine-1-carbonyl)benzenesulfonamide
CID 24816556
4-(3-aminopiperidine-1-carbonyl)-N-(2-methoxyphenyl)benzenesulfonamide;hydrochloride
CID 119381064
4-[4-(cyclopropylmethyl)piperazine-1-carbonyl]-N-(2-methoxyphenyl)benzenesulfonamide
CID 55958812
N-(2-methoxyphenyl)-4-[4-(piperidine-1-carbonyl)piperidine-1-carbonyl]benzenesulfonamide
CID 55349253

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)-4-[(2-methoxyphenyl)sulfamoyl]-N-methylbenzamide?
The IUPAC name of N-(cyclohexylmethyl)-4-[(2-methoxyphenyl)sulfamoyl]-N-methylbenzamide (CID 43057461) is N-(cyclohexylmethyl)-4-[(2-methoxyphenyl)sulfamoyl]-N-methylbenzamide.
What is the SMILES notation for N-(cyclohexylmethyl)-4-[(2-methoxyphenyl)sulfamoyl]-N-methylbenzamide?
The canonical SMILES for N-(cyclohexylmethyl)-4-[(2-methoxyphenyl)sulfamoyl]-N-methylbenzamide is COc1ccccc1NS(=O)(=O)c1ccc(C(=O)N(C)CC2CCCCC2)cc1.
What is the InChIKey of N-(cyclohexylmethyl)-4-[(2-methoxyphenyl)sulfamoyl]-N-methylbenzamide?
The InChIKey is QJFCKXYAMDBKKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O4S/c1-24(16-17-8-4-3-5-9-17)22(25)18-12-14-19(15-13-18)29(26,27)23-20-10-6-7-11-21(20)28-2/h6-7,10-15,17,23H,3-5,8-9,16H2,1-2H3.
What are the key properties of N-(cyclohexylmethyl)-4-[(2-methoxyphenyl)sulfamoyl]-N-methylbenzamide?
N-(cyclohexylmethyl)-4-[(2-methoxyphenyl)sulfamoyl]-N-methylbenzamide has a molecular weight of 416.54 g/mol, XLogP of 4.15, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)-4-[(2-methoxyphenyl)sulfamoyl]-N-methylbenzamide is sourced from PubChem (CID 43057461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).