5-methyl-N-(2-piperidin-1-ylphenyl)thiophene-2-sulfonamide

C16H20N2O2S2 — CID 18191179

IUPAC5-methyl-N-(2-piperidin-1-ylphenyl)thiophene-2-sulfonamide
SMILESCc1ccc(S(=O)(=O)Nc2ccccc2N2CCCCC2)s1
InChIInChI=1S/C16H20N2O2S2/c1-13-9-10-16(21-13)22(19,20)17-14-7-3-4-8-15(14)18-11-5-2-6-12-18/h3-4,7-10,17H,2,5-6,11-12H2,1H3
InChIKeyIRGYSXZCDAWOOC-UHFFFAOYSA-N
MW336.48 g/mol
LogP3.85
Rot. Bonds4

About 5-methyl-N-(2-piperidin-1-ylphenyl)thiophene-2-sulfonamide

5-methyl-N-(2-piperidin-1-ylphenyl)thiophene-2-sulfonamide (PubChem CID 18191179) has the molecular formula C16H20N2O2S2 and a molecular weight of 336.48 g/mol. Its IUPAC name is 5-methyl-N-(2-piperidin-1-ylphenyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-methyl-N-(2-piperidin-1-ylphenyl)thiophene-2-sulfonamide
PubChem CID18191179
Molecular FormulaC16H20N2O2S2
Molecular Weight336.48 g/mol
Exact Mass336.10
IUPAC Name5-methyl-N-(2-piperidin-1-ylphenyl)thiophene-2-sulfonamide
SMILESCc1ccc(S(=O)(=O)Nc2ccccc2N2CCCCC2)s1
InChIInChI=1S/C16H20N2O2S2/c1-13-9-10-16(21-13)22(19,20)17-14-7-3-4-8-15(14)18-11-5-2-6-12-18/h3-4,7-10,17H,2,5-6,11-12H2,1H3
InChIKeyIRGYSXZCDAWOOC-UHFFFAOYSA-N
XLogP3.85
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.48
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(2-piperidin-1-ylphenyl)thiophene-2-sulfonamide?
The IUPAC name of 5-methyl-N-(2-piperidin-1-ylphenyl)thiophene-2-sulfonamide (CID 18191179) is 5-methyl-N-(2-piperidin-1-ylphenyl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-methyl-N-(2-piperidin-1-ylphenyl)thiophene-2-sulfonamide?
The canonical SMILES for 5-methyl-N-(2-piperidin-1-ylphenyl)thiophene-2-sulfonamide is Cc1ccc(S(=O)(=O)Nc2ccccc2N2CCCCC2)s1.
What is the InChIKey of 5-methyl-N-(2-piperidin-1-ylphenyl)thiophene-2-sulfonamide?
The InChIKey is IRGYSXZCDAWOOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2S2/c1-13-9-10-16(21-13)22(19,20)17-14-7-3-4-8-15(14)18-11-5-2-6-12-18/h3-4,7-10,17H,2,5-6,11-12H2,1H3.
What are the key properties of 5-methyl-N-(2-piperidin-1-ylphenyl)thiophene-2-sulfonamide?
5-methyl-N-(2-piperidin-1-ylphenyl)thiophene-2-sulfonamide has a molecular weight of 336.48 g/mol, XLogP of 3.85, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(2-piperidin-1-ylphenyl)thiophene-2-sulfonamide is sourced from PubChem (CID 18191179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).