fluoromethylsulfonyl(methyl)azanide

C2H5FNO2S- — CID 58420842

IUPACfluoromethylsulfonyl(methyl)azanide
SMILESC[N-]S(=O)(=O)CF
InChIInChI=1S/C2H5FNO2S/c1-4-7(5,6)2-3/h2H2,1H3/q-1
InChIKeyADMONZNNBWFKDB-UHFFFAOYSA-N
MW126.13 g/mol
LogP0.25
Rot. Bonds2

About fluoromethylsulfonyl(methyl)azanide

fluoromethylsulfonyl(methyl)azanide (PubChem CID 58420842) has the molecular formula C2H5FNO2S- and a molecular weight of 126.13 g/mol. Its IUPAC name is fluoromethylsulfonyl(methyl)azanide.

Molecular Properties

Compound Namefluoromethylsulfonyl(methyl)azanide
PubChem CID58420842
Molecular FormulaC2H5FNO2S-
Molecular Weight126.13 g/mol
Exact Mass126.00
IUPAC Namefluoromethylsulfonyl(methyl)azanide
SMILESC[N-]S(=O)(=O)CF
InChIInChI=1S/C2H5FNO2S/c1-4-7(5,6)2-3/h2H2,1H3/q-1
InChIKeyADMONZNNBWFKDB-UHFFFAOYSA-N
XLogP0.25
TPSA48.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.13
LogP ≤ 50.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of fluoromethylsulfonyl(methyl)azanide?
The IUPAC name of fluoromethylsulfonyl(methyl)azanide (CID 58420842) is fluoromethylsulfonyl(methyl)azanide.
What is the SMILES notation for fluoromethylsulfonyl(methyl)azanide?
The canonical SMILES for fluoromethylsulfonyl(methyl)azanide is C[N-]S(=O)(=O)CF.
What is the InChIKey of fluoromethylsulfonyl(methyl)azanide?
The InChIKey is ADMONZNNBWFKDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H5FNO2S/c1-4-7(5,6)2-3/h2H2,1H3/q-1.
What are the key properties of fluoromethylsulfonyl(methyl)azanide?
fluoromethylsulfonyl(methyl)azanide has a molecular weight of 126.13 g/mol, XLogP of 0.25, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for fluoromethylsulfonyl(methyl)azanide is sourced from PubChem (CID 58420842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).