N-(2,2,6,6-tetramethylpiperidin-4-yl)dodecane-1-sulfonamide

C21H44N2O2S — CID 20789888

IUPACN-(2,2,6,6-tetramethylpiperidin-4-yl)dodecane-1-sulfonamide
SMILESCCCCCCCCCCCCS(=O)(=O)NC1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C21H44N2O2S/c1-6-7-8-9-10-11-12-13-14-15-16-26(24,25)22-19-17-20(2,3)23-21(4,5)18-19/h19,22-23H,6-18H2,1-5H3
InChIKeyFNYUWQANPZTLON-UHFFFAOYSA-N
MW388.66 g/mol
LogP5.14
Rot. Bonds13

About N-(2,2,6,6-tetramethylpiperidin-4-yl)dodecane-1-sulfonamide

N-(2,2,6,6-tetramethylpiperidin-4-yl)dodecane-1-sulfonamide (PubChem CID 20789888) has the molecular formula C21H44N2O2S and a molecular weight of 388.66 g/mol. Its IUPAC name is N-(2,2,6,6-tetramethylpiperidin-4-yl)dodecane-1-sulfonamide.

Molecular Properties

Compound NameN-(2,2,6,6-tetramethylpiperidin-4-yl)dodecane-1-sulfonamide
PubChem CID20789888
Molecular FormulaC21H44N2O2S
Molecular Weight388.66 g/mol
Exact Mass388.31
IUPAC NameN-(2,2,6,6-tetramethylpiperidin-4-yl)dodecane-1-sulfonamide
SMILESCCCCCCCCCCCCS(=O)(=O)NC1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C21H44N2O2S/c1-6-7-8-9-10-11-12-13-14-15-16-26(24,25)22-19-17-20(2,3)23-21(4,5)18-19/h19,22-23H,6-18H2,1-5H3
InChIKeyFNYUWQANPZTLON-UHFFFAOYSA-N
XLogP5.14
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds13
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500388.66
LogP ≤ 55.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-(2,2,6,6-tetramethylpiperidin-4-yl)dodecane-1-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2,2,6,6-tetramethylpiperidin-4-yl)ethanesulfonamide
CID 64592514
N-cyclopropylhexane-1-sulfonamide
CID 67119181
1-cyano-N-(2,2,6,6-tetramethylpiperidin-4-yl)methanesulfonamide
CID 107857517
4-(propylsulfonylamino)-N-(2,2,6,6-tetramethylpiperidin-4-yl)piperidine-1-carboxamide
CID 86984564
N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine;N-butyl-2,2,6,6-tetramethylpiperidin-4-amine
CID 68740612
N-(3-aminocyclobutyl)butane-1-sulfonamide
CID 43597856
4-chloro-N-(3,3,5,5-tetramethylcyclohexyl)butane-1-sulfonamide
CID 116816465
N-[3-(methylamino)cyclobutyl]butane-1-sulfonamide
CID 178076415
4-decoxy-2,2,6,6-tetramethylpiperidine
CID 141105994
N-dodecyl-2,2,6,6-tetramethylpiperidin-4-amine;2,2,6,6-tetramethylpiperidin-4-one
CID 159184325
N-(1-ethylsulfonylpropan-2-yl)-2,2,6,6-tetramethylpiperidin-4-amine
CID 115900651
N-heptan-3-yl-2,2,6,6-tetramethylpiperidin-4-amine
CID 63944315

Frequently Asked Questions

What is the IUPAC name of N-(2,2,6,6-tetramethylpiperidin-4-yl)dodecane-1-sulfonamide?
The IUPAC name of N-(2,2,6,6-tetramethylpiperidin-4-yl)dodecane-1-sulfonamide (CID 20789888) is N-(2,2,6,6-tetramethylpiperidin-4-yl)dodecane-1-sulfonamide.
What is the SMILES notation for N-(2,2,6,6-tetramethylpiperidin-4-yl)dodecane-1-sulfonamide?
The canonical SMILES for N-(2,2,6,6-tetramethylpiperidin-4-yl)dodecane-1-sulfonamide is CCCCCCCCCCCCS(=O)(=O)NC1CC(C)(C)NC(C)(C)C1.
What is the InChIKey of N-(2,2,6,6-tetramethylpiperidin-4-yl)dodecane-1-sulfonamide?
The InChIKey is FNYUWQANPZTLON-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H44N2O2S/c1-6-7-8-9-10-11-12-13-14-15-16-26(24,25)22-19-17-20(2,3)23-21(4,5)18-19/h19,22-23H,6-18H2,1-5H3.
What are the key properties of N-(2,2,6,6-tetramethylpiperidin-4-yl)dodecane-1-sulfonamide?
N-(2,2,6,6-tetramethylpiperidin-4-yl)dodecane-1-sulfonamide has a molecular weight of 388.66 g/mol, XLogP of 5.14, 13 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2,6,6-tetramethylpiperidin-4-yl)dodecane-1-sulfonamide is sourced from PubChem (CID 20789888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).