2,5-dichloro-N-(1-cyanocyclopentyl)thiophene-3-sulfonamide

C10H10Cl2N2O2S2 — CID 60660889

IUPAC2,5-dichloro-N-(1-cyanocyclopentyl)thiophene-3-sulfonamide
SMILESN#CC1(NS(=O)(=O)c2cc(Cl)sc2Cl)CCCC1
InChIInChI=1S/C10H10Cl2N2O2S2/c11-8-5-7(9(12)17-8)18(15,16)14-10(6-13)3-1-2-4-10/h5,14H,1-4H2
InChIKeySVZNKRRXLYKPRE-UHFFFAOYSA-N
MW325.24 g/mol
LogP3.17
Rot. Bonds3

About 2,5-dichloro-N-(1-cyanocyclopentyl)thiophene-3-sulfonamide

2,5-dichloro-N-(1-cyanocyclopentyl)thiophene-3-sulfonamide (PubChem CID 60660889) has the molecular formula C10H10Cl2N2O2S2 and a molecular weight of 325.24 g/mol. Its IUPAC name is 2,5-dichloro-N-(1-cyanocyclopentyl)thiophene-3-sulfonamide.

Molecular Properties

Compound Name2,5-dichloro-N-(1-cyanocyclopentyl)thiophene-3-sulfonamide
PubChem CID60660889
Molecular FormulaC10H10Cl2N2O2S2
Molecular Weight325.24 g/mol
Exact Mass323.96
IUPAC Name2,5-dichloro-N-(1-cyanocyclopentyl)thiophene-3-sulfonamide
SMILESN#CC1(NS(=O)(=O)c2cc(Cl)sc2Cl)CCCC1
InChIInChI=1S/C10H10Cl2N2O2S2/c11-8-5-7(9(12)17-8)18(15,16)14-10(6-13)3-1-2-4-10/h5,14H,1-4H2
InChIKeySVZNKRRXLYKPRE-UHFFFAOYSA-N
XLogP3.17
TPSA69.96 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.24
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,5-dichloro-N-(1-cyanocyclopentyl)thiophene-3-sulfonamide?
The IUPAC name of 2,5-dichloro-N-(1-cyanocyclopentyl)thiophene-3-sulfonamide (CID 60660889) is 2,5-dichloro-N-(1-cyanocyclopentyl)thiophene-3-sulfonamide.
What is the SMILES notation for 2,5-dichloro-N-(1-cyanocyclopentyl)thiophene-3-sulfonamide?
The canonical SMILES for 2,5-dichloro-N-(1-cyanocyclopentyl)thiophene-3-sulfonamide is N#CC1(NS(=O)(=O)c2cc(Cl)sc2Cl)CCCC1.
What is the InChIKey of 2,5-dichloro-N-(1-cyanocyclopentyl)thiophene-3-sulfonamide?
The InChIKey is SVZNKRRXLYKPRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10Cl2N2O2S2/c11-8-5-7(9(12)17-8)18(15,16)14-10(6-13)3-1-2-4-10/h5,14H,1-4H2.
What are the key properties of 2,5-dichloro-N-(1-cyanocyclopentyl)thiophene-3-sulfonamide?
2,5-dichloro-N-(1-cyanocyclopentyl)thiophene-3-sulfonamide has a molecular weight of 325.24 g/mol, XLogP of 3.17, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dichloro-N-(1-cyanocyclopentyl)thiophene-3-sulfonamide is sourced from PubChem (CID 60660889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).