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

C11H16Cl2N2O2S2 — CID 44755726

IUPAC2,5-dichloro-N-(2-piperidin-1-ylethyl)thiophene-3-sulfonamide
SMILESO=S(=O)(NCCN1CCCCC1)c1cc(Cl)sc1Cl
InChIInChI=1S/C11H16Cl2N2O2S2/c12-10-8-9(11(13)18-10)19(16,17)14-4-7-15-5-2-1-3-6-15/h8,14H,1-7H2
InChIKeyLIEVHWDVAZRHPQ-UHFFFAOYSA-N
MW343.30 g/mol
LogP2.82
Rot. Bonds5

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

2,5-dichloro-N-(2-piperidin-1-ylethyl)thiophene-3-sulfonamide (PubChem CID 44755726) has the molecular formula C11H16Cl2N2O2S2 and a molecular weight of 343.30 g/mol. Its IUPAC name is 2,5-dichloro-N-(2-piperidin-1-ylethyl)thiophene-3-sulfonamide.

Molecular Properties

Compound Name2,5-dichloro-N-(2-piperidin-1-ylethyl)thiophene-3-sulfonamide
PubChem CID44755726
Molecular FormulaC11H16Cl2N2O2S2
Molecular Weight343.30 g/mol
Exact Mass342.00
IUPAC Name2,5-dichloro-N-(2-piperidin-1-ylethyl)thiophene-3-sulfonamide
SMILESO=S(=O)(NCCN1CCCCC1)c1cc(Cl)sc1Cl
InChIInChI=1S/C11H16Cl2N2O2S2/c12-10-8-9(11(13)18-10)19(16,17)14-4-7-15-5-2-1-3-6-15/h8,14H,1-7H2
InChIKeyLIEVHWDVAZRHPQ-UHFFFAOYSA-N
XLogP2.82
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.30
LogP ≤ 52.82
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-(2-piperidin-1-ylethyl)thiophene-3-sulfonamide?
The IUPAC name of 2,5-dichloro-N-(2-piperidin-1-ylethyl)thiophene-3-sulfonamide (CID 44755726) is 2,5-dichloro-N-(2-piperidin-1-ylethyl)thiophene-3-sulfonamide.
What is the SMILES notation for 2,5-dichloro-N-(2-piperidin-1-ylethyl)thiophene-3-sulfonamide?
The canonical SMILES for 2,5-dichloro-N-(2-piperidin-1-ylethyl)thiophene-3-sulfonamide is O=S(=O)(NCCN1CCCCC1)c1cc(Cl)sc1Cl.
What is the InChIKey of 2,5-dichloro-N-(2-piperidin-1-ylethyl)thiophene-3-sulfonamide?
The InChIKey is LIEVHWDVAZRHPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16Cl2N2O2S2/c12-10-8-9(11(13)18-10)19(16,17)14-4-7-15-5-2-1-3-6-15/h8,14H,1-7H2.
What are the key properties of 2,5-dichloro-N-(2-piperidin-1-ylethyl)thiophene-3-sulfonamide?
2,5-dichloro-N-(2-piperidin-1-ylethyl)thiophene-3-sulfonamide has a molecular weight of 343.30 g/mol, XLogP of 2.82, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dichloro-N-(2-piperidin-1-ylethyl)thiophene-3-sulfonamide is sourced from PubChem (CID 44755726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).