bis(trifluoromethylsulfonyl)azanide;N-ethyl-2,2,2-trifluoro-N-(2-methoxyethyl)ethanamine

C9H14F9N2O5S2- — CID 157108793

IUPACbis(trifluoromethylsulfonyl)azanide;N-ethyl-2,2,2-trifluoro-N-(2-methoxyethyl)ethanamine
SMILESCCN(CCOC)CC(F)(F)F.O=S(=O)([N-]S(=O)(=O)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C7H14F3NO.C2F6NO4S2/c1-3-11(4-5-12-2)6-7(8,9)10;3-1(4,5)14(10,11)9-15(12,13)2(6,7)8/h3-6H2,1-2H3;/q;-1
InChIKeyAGPLDUSXKUJIAC-UHFFFAOYSA-N
MW465.34 g/mol
LogP2.58
Rot. Bonds7

About bis(trifluoromethylsulfonyl)azanide;N-ethyl-2,2,2-trifluoro-N-(2-methoxyethyl)ethanamine

bis(trifluoromethylsulfonyl)azanide;N-ethyl-2,2,2-trifluoro-N-(2-methoxyethyl)ethanamine (PubChem CID 157108793) has the molecular formula C9H14F9N2O5S2- and a molecular weight of 465.34 g/mol. Its IUPAC name is bis(trifluoromethylsulfonyl)azanide;N-ethyl-2,2,2-trifluoro-N-(2-methoxyethyl)ethanamine.

Molecular Properties

Compound Namebis(trifluoromethylsulfonyl)azanide;N-ethyl-2,2,2-trifluoro-N-(2-methoxyethyl)ethanamine
PubChem CID157108793
Molecular FormulaC9H14F9N2O5S2-
Molecular Weight465.34 g/mol
Exact Mass465.02
IUPAC Namebis(trifluoromethylsulfonyl)azanide;N-ethyl-2,2,2-trifluoro-N-(2-methoxyethyl)ethanamine
SMILESCCN(CCOC)CC(F)(F)F.O=S(=O)([N-]S(=O)(=O)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C7H14F3NO.C2F6NO4S2/c1-3-11(4-5-12-2)6-7(8,9)10;3-1(4,5)14(10,11)9-15(12,13)2(6,7)8/h3-6H2,1-2H3;/q;-1
InChIKeyAGPLDUSXKUJIAC-UHFFFAOYSA-N
XLogP2.58
TPSA94.85 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500465.34
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

tetramagnesium;tetrakis(bis(trifluoromethylsulfonyl)azanide);octakis(1,2-dimethoxyethane);tetrachloride
CID 139051336
2-[[ethyl(2-methoxyethyl)amino]methyl]-2-methylbutanoic acid
CID 62271797
[ethyl(methyl)sulfamoyl]-(trifluoromethylsulfonyl)azanide
CID 59046682
N,N-diethyl-2-(trifluoromethylsulfonyl)ethanamine
CID 165346498
N'-ethyl-N-(2-methylsulfonylethyl)-N'-(2,2,2-trifluoroethyl)ethane-1,2-diamine
CID 55089721
2-(bromomethyl)-N,2-diethyl-N-(2-methoxyethyl)butan-1-amine
CID 65003436
bis(trifluoromethylsulfonyl)azanide;triethylazanium
CID 11014427
bis(trifluoromethylsulfonyl)azanide;gold(1+)
CID 102109298
bis(trifluoromethylsulfonyl)azanide;uranium
CID 162552088
ethane;N-ethyl-N-(2-methoxyethyl)propan-1-amine
CID 143133671
N-ethyl-N-(2-methoxyethyl)propan-1-amine
CID 59535628
bis(trifluoromethylsulfonyl)azanide;tributyl(methoxymethyl)phosphanium
CID 158418130

Frequently Asked Questions

What is the IUPAC name of bis(trifluoromethylsulfonyl)azanide;N-ethyl-2,2,2-trifluoro-N-(2-methoxyethyl)ethanamine?
The IUPAC name of bis(trifluoromethylsulfonyl)azanide;N-ethyl-2,2,2-trifluoro-N-(2-methoxyethyl)ethanamine (CID 157108793) is bis(trifluoromethylsulfonyl)azanide;N-ethyl-2,2,2-trifluoro-N-(2-methoxyethyl)ethanamine.
What is the SMILES notation for bis(trifluoromethylsulfonyl)azanide;N-ethyl-2,2,2-trifluoro-N-(2-methoxyethyl)ethanamine?
The canonical SMILES for bis(trifluoromethylsulfonyl)azanide;N-ethyl-2,2,2-trifluoro-N-(2-methoxyethyl)ethanamine is CCN(CCOC)CC(F)(F)F.O=S(=O)([N-]S(=O)(=O)C(F)(F)F)C(F)(F)F.
What is the InChIKey of bis(trifluoromethylsulfonyl)azanide;N-ethyl-2,2,2-trifluoro-N-(2-methoxyethyl)ethanamine?
The InChIKey is AGPLDUSXKUJIAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14F3NO.C2F6NO4S2/c1-3-11(4-5-12-2)6-7(8,9)10;3-1(4,5)14(10,11)9-15(12,13)2(6,7)8/h3-6H2,1-2H3;/q;-1.
What are the key properties of bis(trifluoromethylsulfonyl)azanide;N-ethyl-2,2,2-trifluoro-N-(2-methoxyethyl)ethanamine?
bis(trifluoromethylsulfonyl)azanide;N-ethyl-2,2,2-trifluoro-N-(2-methoxyethyl)ethanamine has a molecular weight of 465.34 g/mol, XLogP of 2.58, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for bis(trifluoromethylsulfonyl)azanide;N-ethyl-2,2,2-trifluoro-N-(2-methoxyethyl)ethanamine is sourced from PubChem (CID 157108793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).