12-[methoxy(dimethyl)silyl]-N-(trifluoromethylsulfonyl)dodecanamide

C16H32F3NO4SSi — CID 153300305

IUPAC12-[methoxy(dimethyl)silyl]-N-(trifluoromethylsulfonyl)dodecanamide
SMILESCO[Si](C)(C)CCCCCCCCCCCC(=O)NS(=O)(=O)C(F)(F)F
InChIInChI=1S/C16H32F3NO4SSi/c1-24-26(2,3)14-12-10-8-6-4-5-7-9-11-13-15(21)20-25(22,23)16(17,18)19/h4-14H2,1-3H3,(H,20,21)
InChIKeyKGQZBSPJTHIBIV-UHFFFAOYSA-N
MW419.58 g/mol
LogP4.70
Rot. Bonds14

About 12-[methoxy(dimethyl)silyl]-N-(trifluoromethylsulfonyl)dodecanamide

12-[methoxy(dimethyl)silyl]-N-(trifluoromethylsulfonyl)dodecanamide (PubChem CID 153300305) has the molecular formula C16H32F3NO4SSi and a molecular weight of 419.58 g/mol. Its IUPAC name is 12-[methoxy(dimethyl)silyl]-N-(trifluoromethylsulfonyl)dodecanamide.

Molecular Properties

Compound Name12-[methoxy(dimethyl)silyl]-N-(trifluoromethylsulfonyl)dodecanamide
PubChem CID153300305
Molecular FormulaC16H32F3NO4SSi
Molecular Weight419.58 g/mol
Exact Mass419.18
IUPAC Name12-[methoxy(dimethyl)silyl]-N-(trifluoromethylsulfonyl)dodecanamide
SMILESCO[Si](C)(C)CCCCCCCCCCCC(=O)NS(=O)(=O)C(F)(F)F
InChIInChI=1S/C16H32F3NO4SSi/c1-24-26(2,3)14-12-10-8-6-4-5-7-9-11-13-15(21)20-25(22,23)16(17,18)19/h4-14H2,1-3H3,(H,20,21)
InChIKeyKGQZBSPJTHIBIV-UHFFFAOYSA-N
XLogP4.70
TPSA72.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds14
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500419.58
LogP ≤ 54.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 12-[methoxy(dimethyl)silyl]-N-(trifluoromethylsulfonyl)dodecanamide 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

5-[methoxy(dimethyl)silyl]-N-(trifluoromethylsulfonyl)pentane-1-sulfonamide
CID 153300698
N-ethyl-11-[methoxy(dimethyl)silyl]undecanamide
CID 59782510
5-[methoxy(dimethyl)silyl]-N-(trifluoromethylsulfonyl)hexanamide
CID 153300358
7-methyl-N-(trifluoromethylsulfonyl)octanamide
CID 146494618
4-[methoxy(dimethyl)silyl]-3-methyl-N-(trifluoromethylsulfonyl)butanamide
CID 153300335
N-(trifluoromethylsulfonyl)nonadec-18-enamide
CID 154028090
3,3,3-trifluoro-2-[9-[methoxy(dimethyl)silyl]nonanoyloxy]-2-(trifluoromethyl)propane-1-sulfonic acid
CID 153308380
(9E,12E,15Z)-N-(trifluoromethylsulfonyl)octadeca-9,12,15-trienamide
CID 155170688
3-[11-[methoxy(dimethyl)silyl]undecanoylamino]propyl-trimethylazanium iodide
CID 11670562
14-[methoxy(dimethyl)silyl]tetradecan-4-one
CID 157055533
4-[methoxy(dimethyl)silyl]butylsulfonyl-(trifluoromethylsulfonyl)azanide
CID 153300674
[15-[methoxy(dimethyl)silyl]-5-oxopentadecyl]-trimethylazanium
CID 161078508

Frequently Asked Questions

What is the IUPAC name of 12-[methoxy(dimethyl)silyl]-N-(trifluoromethylsulfonyl)dodecanamide?
The IUPAC name of 12-[methoxy(dimethyl)silyl]-N-(trifluoromethylsulfonyl)dodecanamide (CID 153300305) is 12-[methoxy(dimethyl)silyl]-N-(trifluoromethylsulfonyl)dodecanamide.
What is the SMILES notation for 12-[methoxy(dimethyl)silyl]-N-(trifluoromethylsulfonyl)dodecanamide?
The canonical SMILES for 12-[methoxy(dimethyl)silyl]-N-(trifluoromethylsulfonyl)dodecanamide is CO[Si](C)(C)CCCCCCCCCCCC(=O)NS(=O)(=O)C(F)(F)F.
What is the InChIKey of 12-[methoxy(dimethyl)silyl]-N-(trifluoromethylsulfonyl)dodecanamide?
The InChIKey is KGQZBSPJTHIBIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32F3NO4SSi/c1-24-26(2,3)14-12-10-8-6-4-5-7-9-11-13-15(21)20-25(22,23)16(17,18)19/h4-14H2,1-3H3,(H,20,21).
What are the key properties of 12-[methoxy(dimethyl)silyl]-N-(trifluoromethylsulfonyl)dodecanamide?
12-[methoxy(dimethyl)silyl]-N-(trifluoromethylsulfonyl)dodecanamide has a molecular weight of 419.58 g/mol, XLogP of 4.70, 14 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 12-[methoxy(dimethyl)silyl]-N-(trifluoromethylsulfonyl)dodecanamide is sourced from PubChem (CID 153300305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).