5-ethyl-N-(5-piperidin-1-yl-2-pyridinyl)thiophene-2-sulfonamide

C16H21N3O2S2 — CID 113024663

IUPAC5-ethyl-N-(5-piperidin-1-yl-2-pyridinyl)thiophene-2-sulfonamide
SMILESCCc1ccc(S(=O)(=O)Nc2ccc(N3CCCCC3)cn2)s1
InChIInChI=1S/C16H21N3O2S2/c1-2-14-7-9-16(22-14)23(20,21)18-15-8-6-13(12-17-15)19-10-4-3-5-11-19/h6-9,12H,2-5,10-11H2,1H3,(H,17,18)
InChIKeyALMLMYVKMOAIHN-UHFFFAOYSA-N
MW351.50 g/mol
LogP3.50
Rot. Bonds5

About 5-ethyl-N-(5-piperidin-1-yl-2-pyridinyl)thiophene-2-sulfonamide

5-ethyl-N-(5-piperidin-1-yl-2-pyridinyl)thiophene-2-sulfonamide (PubChem CID 113024663) has the molecular formula C16H21N3O2S2 and a molecular weight of 351.50 g/mol. Its IUPAC name is 5-ethyl-N-(5-piperidin-1-yl-2-pyridinyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-ethyl-N-(5-piperidin-1-yl-2-pyridinyl)thiophene-2-sulfonamide
PubChem CID113024663
Molecular FormulaC16H21N3O2S2
Molecular Weight351.50 g/mol
Exact Mass351.11
IUPAC Name5-ethyl-N-(5-piperidin-1-yl-2-pyridinyl)thiophene-2-sulfonamide
SMILESCCc1ccc(S(=O)(=O)Nc2ccc(N3CCCCC3)cn2)s1
InChIInChI=1S/C16H21N3O2S2/c1-2-14-7-9-16(22-14)23(20,21)18-15-8-6-13(12-17-15)19-10-4-3-5-11-19/h6-9,12H,2-5,10-11H2,1H3,(H,17,18)
InChIKeyALMLMYVKMOAIHN-UHFFFAOYSA-N
XLogP3.50
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.50
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-(5-piperidin-1-yl-2-pyridinyl)thiophene-2-sulfonamide?
The IUPAC name of 5-ethyl-N-(5-piperidin-1-yl-2-pyridinyl)thiophene-2-sulfonamide (CID 113024663) is 5-ethyl-N-(5-piperidin-1-yl-2-pyridinyl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-ethyl-N-(5-piperidin-1-yl-2-pyridinyl)thiophene-2-sulfonamide?
The canonical SMILES for 5-ethyl-N-(5-piperidin-1-yl-2-pyridinyl)thiophene-2-sulfonamide is CCc1ccc(S(=O)(=O)Nc2ccc(N3CCCCC3)cn2)s1.
What is the InChIKey of 5-ethyl-N-(5-piperidin-1-yl-2-pyridinyl)thiophene-2-sulfonamide?
The InChIKey is ALMLMYVKMOAIHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O2S2/c1-2-14-7-9-16(22-14)23(20,21)18-15-8-6-13(12-17-15)19-10-4-3-5-11-19/h6-9,12H,2-5,10-11H2,1H3,(H,17,18).
What are the key properties of 5-ethyl-N-(5-piperidin-1-yl-2-pyridinyl)thiophene-2-sulfonamide?
5-ethyl-N-(5-piperidin-1-yl-2-pyridinyl)thiophene-2-sulfonamide has a molecular weight of 351.50 g/mol, XLogP of 3.50, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-(5-piperidin-1-yl-2-pyridinyl)thiophene-2-sulfonamide is sourced from PubChem (CID 113024663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).