N-(2-ethylsulfanylcyclopentyl)ethanesulfonamide

C9H19NO2S2 — CID 103727787

IUPACN-(2-ethylsulfanylcyclopentyl)ethanesulfonamide
SMILESCCSC1CCCC1NS(=O)(=O)CC
InChIInChI=1S/C9H19NO2S2/c1-3-13-9-7-5-6-8(9)10-14(11,12)4-2/h8-10H,3-7H2,1-2H3
InChIKeyOTQAVROANXWFML-UHFFFAOYSA-N
MW237.39 g/mol
LogP1.60
Rot. Bonds5

About N-(2-ethylsulfanylcyclopentyl)ethanesulfonamide

N-(2-ethylsulfanylcyclopentyl)ethanesulfonamide (PubChem CID 103727787) has the molecular formula C9H19NO2S2 and a molecular weight of 237.39 g/mol. Its IUPAC name is N-(2-ethylsulfanylcyclopentyl)ethanesulfonamide.

Molecular Properties

Compound NameN-(2-ethylsulfanylcyclopentyl)ethanesulfonamide
PubChem CID103727787
Molecular FormulaC9H19NO2S2
Molecular Weight237.39 g/mol
Exact Mass237.09
IUPAC NameN-(2-ethylsulfanylcyclopentyl)ethanesulfonamide
SMILESCCSC1CCCC1NS(=O)(=O)CC
InChIInChI=1S/C9H19NO2S2/c1-3-13-9-7-5-6-8(9)10-14(11,12)4-2/h8-10H,3-7H2,1-2H3
InChIKeyOTQAVROANXWFML-UHFFFAOYSA-N
XLogP1.60
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.39
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(aminomethyl)-N-(2-ethylsulfanylcyclopentyl)piperidine-1-sulfonamide
CID 106093444
5-bromo-N-(2-ethylsulfanylcyclopentyl)pyridine-3-sulfonamide
CID 113249327
N-[2-[[(1R,2S)-2-ethylsulfanylcyclohexyl]amino]ethyl]methanesulfonamide
CID 99790709
N-(2-ethylsulfanylcyclopentyl)-5-(hydroxymethyl)thiophene-3-sulfonamide
CID 106002321
5-(aminomethyl)-N-(2-ethylsulfanylcyclopentyl)-2-methylfuran-3-sulfonamide
CID 106093408
N-(2-ethylsulfanylcyclopentyl)-2-(hydroxymethyl)-4-methylthiophene-3-sulfonamide
CID 106002341
2-chloro-N-(2-ethylsulfanylcyclopentyl)-5-(hydroxymethyl)benzenesulfonamide
CID 106002315
4-(aminomethyl)-3-chloro-N-(2-ethylsulfanylcyclopentyl)benzenesulfonamide
CID 106093469
4-(ethylaminomethyl)-N-(2-ethylsulfanylcyclopentyl)-1H-pyrazole-5-sulfonamide
CID 106093464
(2R)-2-amino-N-(2-ethylsulfanylcyclopentyl)butanamide
CID 104878228
N-[(1S,2S)-2-(hydroxymethyl)cyclohexyl]ethanesulfonamide
CID 86708972
N-(2-propan-2-ylcyclohexyl)ethanesulfonamide
CID 59292409

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylsulfanylcyclopentyl)ethanesulfonamide?
The IUPAC name of N-(2-ethylsulfanylcyclopentyl)ethanesulfonamide (CID 103727787) is N-(2-ethylsulfanylcyclopentyl)ethanesulfonamide.
What is the SMILES notation for N-(2-ethylsulfanylcyclopentyl)ethanesulfonamide?
The canonical SMILES for N-(2-ethylsulfanylcyclopentyl)ethanesulfonamide is CCSC1CCCC1NS(=O)(=O)CC.
What is the InChIKey of N-(2-ethylsulfanylcyclopentyl)ethanesulfonamide?
The InChIKey is OTQAVROANXWFML-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2S2/c1-3-13-9-7-5-6-8(9)10-14(11,12)4-2/h8-10H,3-7H2,1-2H3.
What are the key properties of N-(2-ethylsulfanylcyclopentyl)ethanesulfonamide?
N-(2-ethylsulfanylcyclopentyl)ethanesulfonamide has a molecular weight of 237.39 g/mol, XLogP of 1.60, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylsulfanylcyclopentyl)ethanesulfonamide is sourced from PubChem (CID 103727787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).