N-[1-(hydroxymethyl)cyclopentyl]-4-propylbenzenesulfonamide

C15H23NO3S — CID 62520894

IUPACN-[1-(hydroxymethyl)cyclopentyl]-4-propylbenzenesulfonamide
SMILESCCCc1ccc(S(=O)(=O)NC2(CO)CCCC2)cc1
InChIInChI=1S/C15H23NO3S/c1-2-5-13-6-8-14(9-7-13)20(18,19)16-15(12-17)10-3-4-11-15/h6-9,16-17H,2-5,10-12H2,1H3
InChIKeyDALPWXSFWMUQMM-UHFFFAOYSA-N
MW297.42 g/mol
LogP2.22
Rot. Bonds6

About N-[1-(hydroxymethyl)cyclopentyl]-4-propylbenzenesulfonamide

N-[1-(hydroxymethyl)cyclopentyl]-4-propylbenzenesulfonamide (PubChem CID 62520894) has the molecular formula C15H23NO3S and a molecular weight of 297.42 g/mol. Its IUPAC name is N-[1-(hydroxymethyl)cyclopentyl]-4-propylbenzenesulfonamide.

Molecular Properties

Compound NameN-[1-(hydroxymethyl)cyclopentyl]-4-propylbenzenesulfonamide
PubChem CID62520894
Molecular FormulaC15H23NO3S
Molecular Weight297.42 g/mol
Exact Mass297.14
IUPAC NameN-[1-(hydroxymethyl)cyclopentyl]-4-propylbenzenesulfonamide
SMILESCCCc1ccc(S(=O)(=O)NC2(CO)CCCC2)cc1
InChIInChI=1S/C15H23NO3S/c1-2-5-13-6-8-14(9-7-13)20(18,19)16-15(12-17)10-3-4-11-15/h6-9,16-17H,2-5,10-12H2,1H3
InChIKeyDALPWXSFWMUQMM-UHFFFAOYSA-N
XLogP2.22
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.42
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[1-(hydroxymethyl)cyclopentyl]-4-propylbenzenesulfonamide 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-ethyl-N-[1-(hydroxymethyl)cyclopentyl]benzenesulfonamide
CID 55082213
4-(bromomethyl)-N-[1-(hydroxymethyl)cyclopentyl]benzenesulfonamide
CID 65481622
4-N-[1-(hydroxymethyl)cyclobutyl]-1-N-methylbenzene-1,4-disulfonamide
CID 115903007
4-fluoro-N-[1-(hydroxymethyl)cyclohexyl]benzenesulfonamide
CID 62519723
4-N-[1-(hydroxymethyl)cyclopropyl]-1-N-methylbenzene-1,4-disulfonamide
CID 115902832
4-[[1-(hydroxymethyl)cyclopentyl]sulfamoyl]benzamide
CID 62522485
N-[1-(hydroxymethyl)cyclopentyl]-4-[4-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]phenyl]benzenesulfonamide
CID 143604429
N-[4-(chloromethyl)oxan-4-yl]-4-propylbenzenesulfonamide
CID 106301359
N-[1-(hydroxymethyl)cyclopentyl]-1-methylpyrrole-3-sulfonamide
CID 62519995
N-[1-(hydroxymethyl)cyclopentyl]-6-oxo-1H-pyridine-3-sulfonamide
CID 62521621
N-[1-(hydroxymethyl)cyclopentyl]-1H-pyrrole-3-sulfonamide
CID 62519994
N-[(1-aminocyclohexyl)methyl]-4-propylbenzenesulfonamide
CID 43598214

Frequently Asked Questions

What is the IUPAC name of N-[1-(hydroxymethyl)cyclopentyl]-4-propylbenzenesulfonamide?
The IUPAC name of N-[1-(hydroxymethyl)cyclopentyl]-4-propylbenzenesulfonamide (CID 62520894) is N-[1-(hydroxymethyl)cyclopentyl]-4-propylbenzenesulfonamide.
What is the SMILES notation for N-[1-(hydroxymethyl)cyclopentyl]-4-propylbenzenesulfonamide?
The canonical SMILES for N-[1-(hydroxymethyl)cyclopentyl]-4-propylbenzenesulfonamide is CCCc1ccc(S(=O)(=O)NC2(CO)CCCC2)cc1.
What is the InChIKey of N-[1-(hydroxymethyl)cyclopentyl]-4-propylbenzenesulfonamide?
The InChIKey is DALPWXSFWMUQMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3S/c1-2-5-13-6-8-14(9-7-13)20(18,19)16-15(12-17)10-3-4-11-15/h6-9,16-17H,2-5,10-12H2,1H3.
What are the key properties of N-[1-(hydroxymethyl)cyclopentyl]-4-propylbenzenesulfonamide?
N-[1-(hydroxymethyl)cyclopentyl]-4-propylbenzenesulfonamide has a molecular weight of 297.42 g/mol, XLogP of 2.22, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(hydroxymethyl)cyclopentyl]-4-propylbenzenesulfonamide is sourced from PubChem (CID 62520894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).