N-(4-methyl-2-pyrrolidin-1-ylpentyl)benzenesulfonamide

C16H26N2O2S — CID 110403541

IUPACN-(4-methyl-2-pyrrolidin-1-ylpentyl)benzenesulfonamide
SMILESCC(C)CC(CNS(=O)(=O)c1ccccc1)N1CCCC1
InChIInChI=1S/C16H26N2O2S/c1-14(2)12-15(18-10-6-7-11-18)13-17-21(19,20)16-8-4-3-5-9-16/h3-5,8-9,14-15,17H,6-7,10-13H2,1-2H3
InChIKeyLGGNBTOYZWXHTJ-UHFFFAOYSA-N
MW310.46 g/mol
LogP2.48
Rot. Bonds7

About N-(4-methyl-2-pyrrolidin-1-ylpentyl)benzenesulfonamide

N-(4-methyl-2-pyrrolidin-1-ylpentyl)benzenesulfonamide (PubChem CID 110403541) has the molecular formula C16H26N2O2S and a molecular weight of 310.46 g/mol. Its IUPAC name is N-(4-methyl-2-pyrrolidin-1-ylpentyl)benzenesulfonamide.

Molecular Properties

Compound NameN-(4-methyl-2-pyrrolidin-1-ylpentyl)benzenesulfonamide
PubChem CID110403541
Molecular FormulaC16H26N2O2S
Molecular Weight310.46 g/mol
Exact Mass310.17
IUPAC NameN-(4-methyl-2-pyrrolidin-1-ylpentyl)benzenesulfonamide
SMILESCC(C)CC(CNS(=O)(=O)c1ccccc1)N1CCCC1
InChIInChI=1S/C16H26N2O2S/c1-14(2)12-15(18-10-6-7-11-18)13-17-21(19,20)16-8-4-3-5-9-16/h3-5,8-9,14-15,17H,6-7,10-13H2,1-2H3
InChIKeyLGGNBTOYZWXHTJ-UHFFFAOYSA-N
XLogP2.48
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.46
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(4-methyl-2-pyrrolidin-1-ylpentyl)benzenesulfonamide 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-acetyl-N-(4-methyl-2-pyrrolidin-1-ylpentyl)benzenesulfonamide
CID 110403598
N-(4-methyl-2-piperidin-1-ylpentyl)-3-nitrobenzenesulfonamide
CID 110403448
4-chloro-N-[4-methyl-2-(4-methylpiperazin-1-yl)pentyl]benzenesulfonamide
CID 110403691
1-(2-methylphenyl)-N-(4-methyl-2-piperidin-1-ylpentyl)methanesulfonamide
CID 110403434
3-chloro-N-[4-methyl-2-(4-methylpiperazin-1-yl)pentyl]benzenesulfonamide
CID 110403737
1-methyl-N-(4-methyl-2-pyrrolidin-1-ylpentyl)-2-oxo-3H-indole-5-sulfonamide
CID 110403585
1-methyl-N-(4-methyl-2-piperidin-1-ylpentyl)-2-oxo-3H-indole-5-sulfonamide
CID 110403443
N-[4-[(4-methyl-2-morpholin-4-ylpentyl)sulfamoyl]phenyl]acetamide
CID 110403337
2,6-dichloro-N-(4-methyl-2-morpholin-4-ylpentyl)benzenesulfonamide
CID 46540574
N-(4-methyl-2-pyrrolidin-1-ylpentyl)propane-1-sulfonamide
CID 110403539
N-(2-morpholin-4-yl-3-phenylpropyl)benzenesulfonamide
CID 110403847
4-methyl-N-(2-phenyl-2-piperidin-1-ylethyl)benzenesulfonamide
CID 2784014

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-2-pyrrolidin-1-ylpentyl)benzenesulfonamide?
The IUPAC name of N-(4-methyl-2-pyrrolidin-1-ylpentyl)benzenesulfonamide (CID 110403541) is N-(4-methyl-2-pyrrolidin-1-ylpentyl)benzenesulfonamide.
What is the SMILES notation for N-(4-methyl-2-pyrrolidin-1-ylpentyl)benzenesulfonamide?
The canonical SMILES for N-(4-methyl-2-pyrrolidin-1-ylpentyl)benzenesulfonamide is CC(C)CC(CNS(=O)(=O)c1ccccc1)N1CCCC1.
What is the InChIKey of N-(4-methyl-2-pyrrolidin-1-ylpentyl)benzenesulfonamide?
The InChIKey is LGGNBTOYZWXHTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2S/c1-14(2)12-15(18-10-6-7-11-18)13-17-21(19,20)16-8-4-3-5-9-16/h3-5,8-9,14-15,17H,6-7,10-13H2,1-2H3.
What are the key properties of N-(4-methyl-2-pyrrolidin-1-ylpentyl)benzenesulfonamide?
N-(4-methyl-2-pyrrolidin-1-ylpentyl)benzenesulfonamide has a molecular weight of 310.46 g/mol, XLogP of 2.48, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-2-pyrrolidin-1-ylpentyl)benzenesulfonamide is sourced from PubChem (CID 110403541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).