4-ethyl-N-[2-(hydroxymethyl)cyclopentyl]benzenesulfonamide

C14H21NO3S — CID 103835956

IUPAC4-ethyl-N-[2-(hydroxymethyl)cyclopentyl]benzenesulfonamide
SMILESCCc1ccc(S(=O)(=O)NC2CCCC2CO)cc1
InChIInChI=1S/C14H21NO3S/c1-2-11-6-8-13(9-7-11)19(17,18)15-14-5-3-4-12(14)10-16/h6-9,12,14-16H,2-5,10H2,1H3
InChIKeyPOGASIMRPYRMKA-UHFFFAOYSA-N
MW283.39 g/mol
LogP1.69
Rot. Bonds5

About 4-ethyl-N-[2-(hydroxymethyl)cyclopentyl]benzenesulfonamide

4-ethyl-N-[2-(hydroxymethyl)cyclopentyl]benzenesulfonamide (PubChem CID 103835956) has the molecular formula C14H21NO3S and a molecular weight of 283.39 g/mol. Its IUPAC name is 4-ethyl-N-[2-(hydroxymethyl)cyclopentyl]benzenesulfonamide.

Molecular Properties

Compound Name4-ethyl-N-[2-(hydroxymethyl)cyclopentyl]benzenesulfonamide
PubChem CID103835956
Molecular FormulaC14H21NO3S
Molecular Weight283.39 g/mol
Exact Mass283.12
IUPAC Name4-ethyl-N-[2-(hydroxymethyl)cyclopentyl]benzenesulfonamide
SMILESCCc1ccc(S(=O)(=O)NC2CCCC2CO)cc1
InChIInChI=1S/C14H21NO3S/c1-2-11-6-8-13(9-7-11)19(17,18)15-14-5-3-4-12(14)10-16/h6-9,12,14-16H,2-5,10H2,1H3
InChIKeyPOGASIMRPYRMKA-UHFFFAOYSA-N
XLogP1.69
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.39
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2-chloroethyl)-N-[2-(hydroxymethyl)cyclohexyl]benzenesulfonamide
CID 103858722
6-chloro-N-[2-(hydroxymethyl)cyclopentyl]pyridine-3-sulfonamide
CID 103836075
3-chloro-4-fluoro-N-[2-(hydroxymethyl)cyclopentyl]benzenesulfonamide
CID 103836042
4-[[2-(hydroxymethyl)cyclopentyl]amino]-N-methylbenzenesulfonamide
CID 106362103
N-(2-ethylcyclohexyl)-4-ethylsulfonylbenzenesulfonamide
CID 60530988
N-[2-(bromomethyl)cyclopentyl]-4-methylbenzenesulfonamide
CID 106367542
N-(2-aminocyclopentyl)-4-propylbenzenesulfonamide
CID 63251903
N-[2-(hydroxymethyl)cyclopentyl]-2,4-dimethylbenzenesulfonamide
CID 103835923
4-(hydroxymethyl)-N-(2-methylsulfanylcyclopentyl)benzenesulfonamide
CID 106001430
N-[2-(hydroxymethyl)cyclopentyl]-5-methylthiophene-2-sulfonamide
CID 113318676
4-bromo-N-[2-(bromomethyl)cyclopentyl]benzenesulfonamide
CID 106367478
[2-[1-(4-ethylphenyl)ethylamino]cyclopentyl]methanol
CID 103786035

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-[2-(hydroxymethyl)cyclopentyl]benzenesulfonamide?
The IUPAC name of 4-ethyl-N-[2-(hydroxymethyl)cyclopentyl]benzenesulfonamide (CID 103835956) is 4-ethyl-N-[2-(hydroxymethyl)cyclopentyl]benzenesulfonamide.
What is the SMILES notation for 4-ethyl-N-[2-(hydroxymethyl)cyclopentyl]benzenesulfonamide?
The canonical SMILES for 4-ethyl-N-[2-(hydroxymethyl)cyclopentyl]benzenesulfonamide is CCc1ccc(S(=O)(=O)NC2CCCC2CO)cc1.
What is the InChIKey of 4-ethyl-N-[2-(hydroxymethyl)cyclopentyl]benzenesulfonamide?
The InChIKey is POGASIMRPYRMKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO3S/c1-2-11-6-8-13(9-7-11)19(17,18)15-14-5-3-4-12(14)10-16/h6-9,12,14-16H,2-5,10H2,1H3.
What are the key properties of 4-ethyl-N-[2-(hydroxymethyl)cyclopentyl]benzenesulfonamide?
4-ethyl-N-[2-(hydroxymethyl)cyclopentyl]benzenesulfonamide has a molecular weight of 283.39 g/mol, XLogP of 1.69, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-[2-(hydroxymethyl)cyclopentyl]benzenesulfonamide is sourced from PubChem (CID 103835956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).