2-(2,2-difluorocyclopentyl)ethanesulfonamide

C7H13F2NO2S — CID 165486158

IUPAC2-(2,2-difluorocyclopentyl)ethanesulfonamide
SMILESNS(=O)(=O)CCC1CCCC1(F)F
InChIInChI=1S/C7H13F2NO2S/c8-7(9)4-1-2-6(7)3-5-13(10,11)12/h6H,1-5H2,(H2,10,11,12)
InChIKeyONXRXMOYKNPUOW-UHFFFAOYSA-N
MW213.25 g/mol
LogP1.10
Rot. Bonds3

About 2-(2,2-difluorocyclopentyl)ethanesulfonamide

2-(2,2-difluorocyclopentyl)ethanesulfonamide (PubChem CID 165486158) has the molecular formula C7H13F2NO2S and a molecular weight of 213.25 g/mol. Its IUPAC name is 2-(2,2-difluorocyclopentyl)ethanesulfonamide.

Molecular Properties

Compound Name2-(2,2-difluorocyclopentyl)ethanesulfonamide
PubChem CID165486158
Molecular FormulaC7H13F2NO2S
Molecular Weight213.25 g/mol
Exact Mass213.06
IUPAC Name2-(2,2-difluorocyclopentyl)ethanesulfonamide
SMILESNS(=O)(=O)CCC1CCCC1(F)F
InChIInChI=1S/C7H13F2NO2S/c8-7(9)4-1-2-6(7)3-5-13(10,11)12/h6H,1-5H2,(H2,10,11,12)
InChIKeyONXRXMOYKNPUOW-UHFFFAOYSA-N
XLogP1.10
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.25
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,2-difluorocyclopentyl)ethanesulfonamide?
The IUPAC name of 2-(2,2-difluorocyclopentyl)ethanesulfonamide (CID 165486158) is 2-(2,2-difluorocyclopentyl)ethanesulfonamide.
What is the SMILES notation for 2-(2,2-difluorocyclopentyl)ethanesulfonamide?
The canonical SMILES for 2-(2,2-difluorocyclopentyl)ethanesulfonamide is NS(=O)(=O)CCC1CCCC1(F)F.
What is the InChIKey of 2-(2,2-difluorocyclopentyl)ethanesulfonamide?
The InChIKey is ONXRXMOYKNPUOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13F2NO2S/c8-7(9)4-1-2-6(7)3-5-13(10,11)12/h6H,1-5H2,(H2,10,11,12).
What are the key properties of 2-(2,2-difluorocyclopentyl)ethanesulfonamide?
2-(2,2-difluorocyclopentyl)ethanesulfonamide has a molecular weight of 213.25 g/mol, XLogP of 1.10, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-difluorocyclopentyl)ethanesulfonamide is sourced from PubChem (CID 165486158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).