N-(3,3-dimethylcyclopentyl)-4-methyl-3-sulfamoylbenzamide

C15H22N2O3S — CID 115880894

IUPACN-(3,3-dimethylcyclopentyl)-4-methyl-3-sulfamoylbenzamide
SMILESCc1ccc(C(=O)NC2CCC(C)(C)C2)cc1S(N)(=O)=O
InChIInChI=1S/C15H22N2O3S/c1-10-4-5-11(8-13(10)21(16,19)20)14(18)17-12-6-7-15(2,3)9-12/h4-5,8,12H,6-7,9H2,1-3H3,(H,17,18)(H2,16,19,20)
InChIKeyBJHHMJOMUPUHBL-UHFFFAOYSA-N
MW310.42 g/mol
LogP1.95
Rot. Bonds3

About N-(3,3-dimethylcyclopentyl)-4-methyl-3-sulfamoylbenzamide

N-(3,3-dimethylcyclopentyl)-4-methyl-3-sulfamoylbenzamide (PubChem CID 115880894) has the molecular formula C15H22N2O3S and a molecular weight of 310.42 g/mol. Its IUPAC name is N-(3,3-dimethylcyclopentyl)-4-methyl-3-sulfamoylbenzamide.

Molecular Properties

Compound NameN-(3,3-dimethylcyclopentyl)-4-methyl-3-sulfamoylbenzamide
PubChem CID115880894
Molecular FormulaC15H22N2O3S
Molecular Weight310.42 g/mol
Exact Mass310.14
IUPAC NameN-(3,3-dimethylcyclopentyl)-4-methyl-3-sulfamoylbenzamide
SMILESCc1ccc(C(=O)NC2CCC(C)(C)C2)cc1S(N)(=O)=O
InChIInChI=1S/C15H22N2O3S/c1-10-4-5-11(8-13(10)21(16,19)20)14(18)17-12-6-7-15(2,3)9-12/h4-5,8,12H,6-7,9H2,1-3H3,(H,17,18)(H2,16,19,20)
InChIKeyBJHHMJOMUPUHBL-UHFFFAOYSA-N
XLogP1.95
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.42
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(3,3-dimethylcyclopentyl)-4-methyl-3-sulfamoylbenzamide 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-(3,3-dimethylcyclopentyl)-4-fluoro-3-sulfamoylbenzamide
CID 115880589
3-amino-N-(3,3-dimethylcyclopentyl)-4-methylbenzamide
CID 114542653
N-(3,3-dimethylcyclopentyl)-3-methyl-4-(methylamino)benzamide
CID 114540797
N-(3,3-dimethylcyclopentyl)-3-fluoro-5-sulfamoylbenzamide
CID 115880821
4-chloro-N-(3,3-dimethylcyclopentyl)benzamide
CID 91506548
N-(3,3-dimethylcyclopentyl)-2-methyl-4-(propylamino)benzamide
CID 114540826
4-methyl-N-(7-oxabicyclo[2.2.1]heptan-2-yl)-3-sulfamoylbenzamide
CID 80611769
4-amino-N-(3,3-dimethylcyclopentyl)-3,5-difluorobenzamide
CID 114540712
N-(3,3-dimethylcyclopentyl)quinoline-6-carboxamide
CID 115881808
4-[(carbamoylamino)methyl]-N-(3,3-dimethylcyclopentyl)benzamide
CID 115880620
3-cyano-N-(3,3-dimethylcyclopentyl)benzamide
CID 115880768
N-[(4R)-3,4-dihydro-2H-chromen-4-yl]-4-methyl-3-sulfamoylbenzamide
CID 9091692

Frequently Asked Questions

What is the IUPAC name of N-(3,3-dimethylcyclopentyl)-4-methyl-3-sulfamoylbenzamide?
The IUPAC name of N-(3,3-dimethylcyclopentyl)-4-methyl-3-sulfamoylbenzamide (CID 115880894) is N-(3,3-dimethylcyclopentyl)-4-methyl-3-sulfamoylbenzamide.
What is the SMILES notation for N-(3,3-dimethylcyclopentyl)-4-methyl-3-sulfamoylbenzamide?
The canonical SMILES for N-(3,3-dimethylcyclopentyl)-4-methyl-3-sulfamoylbenzamide is Cc1ccc(C(=O)NC2CCC(C)(C)C2)cc1S(N)(=O)=O.
What is the InChIKey of N-(3,3-dimethylcyclopentyl)-4-methyl-3-sulfamoylbenzamide?
The InChIKey is BJHHMJOMUPUHBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3S/c1-10-4-5-11(8-13(10)21(16,19)20)14(18)17-12-6-7-15(2,3)9-12/h4-5,8,12H,6-7,9H2,1-3H3,(H,17,18)(H2,16,19,20).
What are the key properties of N-(3,3-dimethylcyclopentyl)-4-methyl-3-sulfamoylbenzamide?
N-(3,3-dimethylcyclopentyl)-4-methyl-3-sulfamoylbenzamide has a molecular weight of 310.42 g/mol, XLogP of 1.95, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-dimethylcyclopentyl)-4-methyl-3-sulfamoylbenzamide is sourced from PubChem (CID 115880894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).