4-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzenesulfonamide

C16H26N2O2S — CID 825437

IUPAC4-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzenesulfonamide
SMILESCc1ccc(S(=O)(=O)NC2CC(C)(C)NC(C)(C)C2)cc1
InChIInChI=1S/C16H26N2O2S/c1-12-6-8-14(9-7-12)21(19,20)17-13-10-15(2,3)18-16(4,5)11-13/h6-9,13,17-18H,10-11H2,1-5H3
InChIKeyLNDPCWUBYCIBKW-UHFFFAOYSA-N
MW310.46 g/mol
LogP2.58
Rot. Bonds3

About 4-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzenesulfonamide

4-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzenesulfonamide (PubChem CID 825437) has the molecular formula C16H26N2O2S and a molecular weight of 310.46 g/mol. Its IUPAC name is 4-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzenesulfonamide.

Molecular Properties

Compound Name4-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzenesulfonamide
PubChem CID825437
Molecular FormulaC16H26N2O2S
Molecular Weight310.46 g/mol
Exact Mass310.17
IUPAC Name4-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzenesulfonamide
SMILESCc1ccc(S(=O)(=O)NC2CC(C)(C)NC(C)(C)C2)cc1
InChIInChI=1S/C16H26N2O2S/c1-12-6-8-14(9-7-12)21(19,20)17-13-10-15(2,3)18-16(4,5)11-13/h6-9,13,17-18H,10-11H2,1-5H3
InChIKeyLNDPCWUBYCIBKW-UHFFFAOYSA-N
XLogP2.58
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.46
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzenesulfonamide?
The IUPAC name of 4-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzenesulfonamide (CID 825437) is 4-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzenesulfonamide.
What is the SMILES notation for 4-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzenesulfonamide?
The canonical SMILES for 4-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzenesulfonamide is Cc1ccc(S(=O)(=O)NC2CC(C)(C)NC(C)(C)C2)cc1.
What is the InChIKey of 4-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzenesulfonamide?
The InChIKey is LNDPCWUBYCIBKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2S/c1-12-6-8-14(9-7-12)21(19,20)17-13-10-15(2,3)18-16(4,5)11-13/h6-9,13,17-18H,10-11H2,1-5H3.
What are the key properties of 4-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzenesulfonamide?
4-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzenesulfonamide has a molecular weight of 310.46 g/mol, XLogP of 2.58, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzenesulfonamide is sourced from PubChem (CID 825437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).