N,2-dimethyl-5-[(4-methylphenyl)sulfamoyl]-N-pyrrolidin-3-ylbenzamide

C20H25N3O3S — CID 119554301

IUPACN,2-dimethyl-5-[(4-methylphenyl)sulfamoyl]-N-pyrrolidin-3-ylbenzamide
SMILESCc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)N(C)C3CCNC3)c2)cc1
InChIInChI=1S/C20H25N3O3S/c1-14-4-7-16(8-5-14)22-27(25,26)18-9-6-15(2)19(12-18)20(24)23(3)17-10-11-21-13-17/h4-9,12,17,21-22H,10-11,13H2,1-3H3
InChIKeyRNAPJMPLAHXUMI-UHFFFAOYSA-N
MW387.51 g/mol
LogP2.54
Rot. Bonds5

About N,2-dimethyl-5-[(4-methylphenyl)sulfamoyl]-N-pyrrolidin-3-ylbenzamide

N,2-dimethyl-5-[(4-methylphenyl)sulfamoyl]-N-pyrrolidin-3-ylbenzamide (PubChem CID 119554301) has the molecular formula C20H25N3O3S and a molecular weight of 387.51 g/mol. Its IUPAC name is N,2-dimethyl-5-[(4-methylphenyl)sulfamoyl]-N-pyrrolidin-3-ylbenzamide.

Molecular Properties

Compound NameN,2-dimethyl-5-[(4-methylphenyl)sulfamoyl]-N-pyrrolidin-3-ylbenzamide
PubChem CID119554301
Molecular FormulaC20H25N3O3S
Molecular Weight387.51 g/mol
Exact Mass387.16
IUPAC NameN,2-dimethyl-5-[(4-methylphenyl)sulfamoyl]-N-pyrrolidin-3-ylbenzamide
SMILESCc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)N(C)C3CCNC3)c2)cc1
InChIInChI=1S/C20H25N3O3S/c1-14-4-7-16(8-5-14)22-27(25,26)18-9-6-15(2)19(12-18)20(24)23(3)17-10-11-21-13-17/h4-9,12,17,21-22H,10-11,13H2,1-3H3
InChIKeyRNAPJMPLAHXUMI-UHFFFAOYSA-N
XLogP2.54
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.51
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N,2-dimethyl-5-[(4-methylphenyl)sulfamoyl]-N-pyrrolidin-3-ylbenzamide 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-[(3,4-dimethylphenyl)sulfonylamino]-N-methyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119550537
5-(cyclopropylsulfamoyl)-N,2-dimethyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119552011
5-(ethylsulfamoyl)-N,2-dimethyl-N-piperidin-4-ylbenzamide
CID 119441544
3-[(3-fluoro-4-methylphenyl)sulfonylamino]-N-methyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119552441
2-[(4-fluoro-3-methylphenyl)sulfonylamino]-N-methyl-N-pyrrolidin-3-ylbenzamide
CID 119553054
4-[(4-methoxyphenyl)sulfamoyl]-N-methyl-N-pyrrolidin-3-ylbenzamide
CID 119551846
N-(cyclopropylmethyl)-2-methyl-5-[(4-methylphenyl)sulfamoyl]benzamide
CID 24670405
N-cyclohexyl-2-methyl-5-[(4-methylphenyl)sulfamoyl]benzamide
CID 26534981
5-fluoro-N,2-dimethyl-N-piperidin-3-ylbenzamide
CID 55228435
N,2-dimethyl-5-[(4-methylphenyl)sulfamoyl]-N-(2-pyrrolidin-1-ylethyl)benzamide
CID 56510388
5-[(4-fluorophenyl)sulfamoyl]-2-methyl-N-piperidin-4-ylbenzamide
CID 119386331
N,2-dimethyl-5-[(4-methylphenyl)sulfamoyl]benzamide
CID 51163000

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-5-[(4-methylphenyl)sulfamoyl]-N-pyrrolidin-3-ylbenzamide?
The IUPAC name of N,2-dimethyl-5-[(4-methylphenyl)sulfamoyl]-N-pyrrolidin-3-ylbenzamide (CID 119554301) is N,2-dimethyl-5-[(4-methylphenyl)sulfamoyl]-N-pyrrolidin-3-ylbenzamide.
What is the SMILES notation for N,2-dimethyl-5-[(4-methylphenyl)sulfamoyl]-N-pyrrolidin-3-ylbenzamide?
The canonical SMILES for N,2-dimethyl-5-[(4-methylphenyl)sulfamoyl]-N-pyrrolidin-3-ylbenzamide is Cc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)N(C)C3CCNC3)c2)cc1.
What is the InChIKey of N,2-dimethyl-5-[(4-methylphenyl)sulfamoyl]-N-pyrrolidin-3-ylbenzamide?
The InChIKey is RNAPJMPLAHXUMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O3S/c1-14-4-7-16(8-5-14)22-27(25,26)18-9-6-15(2)19(12-18)20(24)23(3)17-10-11-21-13-17/h4-9,12,17,21-22H,10-11,13H2,1-3H3.
What are the key properties of N,2-dimethyl-5-[(4-methylphenyl)sulfamoyl]-N-pyrrolidin-3-ylbenzamide?
N,2-dimethyl-5-[(4-methylphenyl)sulfamoyl]-N-pyrrolidin-3-ylbenzamide has a molecular weight of 387.51 g/mol, XLogP of 2.54, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-5-[(4-methylphenyl)sulfamoyl]-N-pyrrolidin-3-ylbenzamide is sourced from PubChem (CID 119554301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).