decylsulfonyl(trifluoromethylsulfonyl)azanide

C11H21F3NO4S2- — CID 59998584

IUPACdecylsulfonyl(trifluoromethylsulfonyl)azanide
SMILESCCCCCCCCCCS(=O)(=O)[N-]S(=O)(=O)C(F)(F)F
InChIInChI=1S/C11H21F3NO4S2/c1-2-3-4-5-6-7-8-9-10-20(16,17)15-21(18,19)11(12,13)14/h2-10H2,1H3/q-1
InChIKeyYBDJQYIHHCBMMZ-UHFFFAOYSA-N
MW352.42 g/mol
LogP3.68
Rot. Bonds11

About decylsulfonyl(trifluoromethylsulfonyl)azanide

decylsulfonyl(trifluoromethylsulfonyl)azanide (PubChem CID 59998584) has the molecular formula C11H21F3NO4S2- and a molecular weight of 352.42 g/mol. Its IUPAC name is decylsulfonyl(trifluoromethylsulfonyl)azanide.

Molecular Properties

Compound Namedecylsulfonyl(trifluoromethylsulfonyl)azanide
PubChem CID59998584
Molecular FormulaC11H21F3NO4S2-
Molecular Weight352.42 g/mol
Exact Mass352.09
IUPAC Namedecylsulfonyl(trifluoromethylsulfonyl)azanide
SMILESCCCCCCCCCCS(=O)(=O)[N-]S(=O)(=O)C(F)(F)F
InChIInChI=1S/C11H21F3NO4S2/c1-2-3-4-5-6-7-8-9-10-20(16,17)15-21(18,19)11(12,13)14/h2-10H2,1H3/q-1
InChIKeyYBDJQYIHHCBMMZ-UHFFFAOYSA-N
XLogP3.68
TPSA82.38 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.42
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-[butyl(dimethyl)azaniumyl]propylsulfonyl-(trifluoromethylsulfonyl)azanide
CID 177489735
1,1,1,2-tetrafluorotetradecan-2-ylsulfonyl(trifluoromethylsulfonyl)azanide
CID 59046742
bis(trifluoromethylsulfonyl)azanide;triheptylazanium
CID 134716538
bis(trifluoromethylsulfonyl)azanide;tris-decyl(methyl)azanium
CID 175748915
bis(trifluoromethylsulfonyl)azanide;didecyl-methyl-octylazanium
CID 175748919
bis(trifluoromethylsulfonyl)azanide;hexyl(trimethyl)azanium
CID 12991990
4-[methoxy(dimethyl)silyl]butylsulfonyl-(trifluoromethylsulfonyl)azanide
CID 153300674
bis(trifluoromethylsulfonyl)azanide;tetrabutylphosphanium
CID 158388046
bis(trifluoromethylsulfonyl)azanide;tetrapropylazanium
CID 141376230
bis(trifluoromethylsulfonyl)azanide;dodecyl-bis(2-hydroxyethyl)-methylazanium
CID 141217234
tricosane;trifluoromethanesulfonic acid
CID 161255361
bis(trifluoromethylsulfonyl)azanide;butyl(trimethyl)azanium
CID 12991988

Frequently Asked Questions

What is the IUPAC name of decylsulfonyl(trifluoromethylsulfonyl)azanide?
The IUPAC name of decylsulfonyl(trifluoromethylsulfonyl)azanide (CID 59998584) is decylsulfonyl(trifluoromethylsulfonyl)azanide.
What is the SMILES notation for decylsulfonyl(trifluoromethylsulfonyl)azanide?
The canonical SMILES for decylsulfonyl(trifluoromethylsulfonyl)azanide is CCCCCCCCCCS(=O)(=O)[N-]S(=O)(=O)C(F)(F)F.
What is the InChIKey of decylsulfonyl(trifluoromethylsulfonyl)azanide?
The InChIKey is YBDJQYIHHCBMMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21F3NO4S2/c1-2-3-4-5-6-7-8-9-10-20(16,17)15-21(18,19)11(12,13)14/h2-10H2,1H3/q-1.
What are the key properties of decylsulfonyl(trifluoromethylsulfonyl)azanide?
decylsulfonyl(trifluoromethylsulfonyl)azanide has a molecular weight of 352.42 g/mol, XLogP of 3.68, 11 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for decylsulfonyl(trifluoromethylsulfonyl)azanide is sourced from PubChem (CID 59998584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).