N-(2,3-dimethylcyclopentyl)benzenesulfonamide

C13H19NO2S — CID 64923273

IUPACN-(2,3-dimethylcyclopentyl)benzenesulfonamide
SMILESCC1CCC(NS(=O)(=O)c2ccccc2)C1C
InChIInChI=1S/C13H19NO2S/c1-10-8-9-13(11(10)2)14-17(15,16)12-6-4-3-5-7-12/h3-7,10-11,13-14H,8-9H2,1-2H3
InChIKeyQWOUIUTWEUFRMC-UHFFFAOYSA-N
MW253.37 g/mol
LogP2.40
Rot. Bonds3

About N-(2,3-dimethylcyclopentyl)benzenesulfonamide

N-(2,3-dimethylcyclopentyl)benzenesulfonamide (PubChem CID 64923273) has the molecular formula C13H19NO2S and a molecular weight of 253.37 g/mol. Its IUPAC name is N-(2,3-dimethylcyclopentyl)benzenesulfonamide.

Molecular Properties

Compound NameN-(2,3-dimethylcyclopentyl)benzenesulfonamide
PubChem CID64923273
Molecular FormulaC13H19NO2S
Molecular Weight253.37 g/mol
Exact Mass253.11
IUPAC NameN-(2,3-dimethylcyclopentyl)benzenesulfonamide
SMILESCC1CCC(NS(=O)(=O)c2ccccc2)C1C
InChIInChI=1S/C13H19NO2S/c1-10-8-9-13(11(10)2)14-17(15,16)12-6-4-3-5-7-12/h3-7,10-11,13-14H,8-9H2,1-2H3
InChIKeyQWOUIUTWEUFRMC-UHFFFAOYSA-N
XLogP2.40
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.37
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,3-dimethylcyclopentyl)-4-fluorobenzenesulfonamide
CID 64907614
N-(2,3-dimethylcyclopentyl)-4-(methylaminomethyl)benzenesulfonamide
CID 64920857
N-(2,3-dimethylcyclopentyl)-3-(1-hydroxyethyl)benzenesulfonamide
CID 64922458
N-[(1S,2R,3S)-2,3-dimethylcyclohexyl]-4-methylbenzenesulfonamide
CID 7728447
4-bromo-N-[(1R,2R,3R)-2,3-dimethylcyclohexyl]benzenesulfonamide
CID 11895768
N-(2,3-dimethylcyclopentyl)-2-hydrazinylbenzenesulfonamide
CID 64922831
6-amino-N-(2,3-dimethylcyclopentyl)pyridine-3-sulfonamide
CID 64909491
3-(3-aminoprop-1-ynyl)-N-(2,3-dimethylcyclopentyl)benzenesulfonamide
CID 64921082
2-bromo-N-[(1S,2R,3R)-2,3-dimethylcyclohexyl]benzenesulfonamide
CID 11928444
N-(3-methylpiperidin-4-yl)-4-phenylbenzenesulfonamide
CID 120724798
2-amino-N-(2,3-dimethylcyclopentyl)pyridine-3-sulfonamide
CID 64923261
6-cyano-N-(2,3-dimethylcyclopentyl)pyridine-3-sulfonamide
CID 114613875

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylcyclopentyl)benzenesulfonamide?
The IUPAC name of N-(2,3-dimethylcyclopentyl)benzenesulfonamide (CID 64923273) is N-(2,3-dimethylcyclopentyl)benzenesulfonamide.
What is the SMILES notation for N-(2,3-dimethylcyclopentyl)benzenesulfonamide?
The canonical SMILES for N-(2,3-dimethylcyclopentyl)benzenesulfonamide is CC1CCC(NS(=O)(=O)c2ccccc2)C1C.
What is the InChIKey of N-(2,3-dimethylcyclopentyl)benzenesulfonamide?
The InChIKey is QWOUIUTWEUFRMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2S/c1-10-8-9-13(11(10)2)14-17(15,16)12-6-4-3-5-7-12/h3-7,10-11,13-14H,8-9H2,1-2H3.
What are the key properties of N-(2,3-dimethylcyclopentyl)benzenesulfonamide?
N-(2,3-dimethylcyclopentyl)benzenesulfonamide has a molecular weight of 253.37 g/mol, XLogP of 2.40, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylcyclopentyl)benzenesulfonamide is sourced from PubChem (CID 64923273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).