N-methylmethanamine;N-(trifluoromethylsulfonyl)sulfamoyl fluoride

C3H8F4N2O4S2 — CID 118659705

IUPACN-methylmethanamine;N-(trifluoromethylsulfonyl)sulfamoyl fluoride
SMILESCNC.O=S(=O)(F)NS(=O)(=O)C(F)(F)F
InChIInChI=1S/C2H7N.CHF4NO4S2/c1-3-2;2-1(3,4)11(7,8)6-12(5,9)10/h3H,1-2H3;6H
InChIKeyORWXWQCEDIJOFT-UHFFFAOYSA-N
MW276.23 g/mol
LogP-0.52
Rot. Bonds2

About N-methylmethanamine;N-(trifluoromethylsulfonyl)sulfamoyl fluoride

N-methylmethanamine;N-(trifluoromethylsulfonyl)sulfamoyl fluoride (PubChem CID 118659705) has the molecular formula C3H8F4N2O4S2 and a molecular weight of 276.23 g/mol. Its IUPAC name is N-methylmethanamine;N-(trifluoromethylsulfonyl)sulfamoyl fluoride.

Molecular Properties

Compound NameN-methylmethanamine;N-(trifluoromethylsulfonyl)sulfamoyl fluoride
PubChem CID118659705
Molecular FormulaC3H8F4N2O4S2
Molecular Weight276.23 g/mol
Exact Mass275.99
IUPAC NameN-methylmethanamine;N-(trifluoromethylsulfonyl)sulfamoyl fluoride
SMILESCNC.O=S(=O)(F)NS(=O)(=O)C(F)(F)F
InChIInChI=1S/C2H7N.CHF4NO4S2/c1-3-2;2-1(3,4)11(7,8)6-12(5,9)10/h3H,1-2H3;6H
InChIKeyORWXWQCEDIJOFT-UHFFFAOYSA-N
XLogP-0.52
TPSA92.34 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.23
LogP ≤ 5-0.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methylmethanamine;N-(trifluoromethylsulfonyl)sulfamoyl fluoride?
The IUPAC name of N-methylmethanamine;N-(trifluoromethylsulfonyl)sulfamoyl fluoride (CID 118659705) is N-methylmethanamine;N-(trifluoromethylsulfonyl)sulfamoyl fluoride.
What is the SMILES notation for N-methylmethanamine;N-(trifluoromethylsulfonyl)sulfamoyl fluoride?
The canonical SMILES for N-methylmethanamine;N-(trifluoromethylsulfonyl)sulfamoyl fluoride is CNC.O=S(=O)(F)NS(=O)(=O)C(F)(F)F.
What is the InChIKey of N-methylmethanamine;N-(trifluoromethylsulfonyl)sulfamoyl fluoride?
The InChIKey is ORWXWQCEDIJOFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H7N.CHF4NO4S2/c1-3-2;2-1(3,4)11(7,8)6-12(5,9)10/h3H,1-2H3;6H.
What are the key properties of N-methylmethanamine;N-(trifluoromethylsulfonyl)sulfamoyl fluoride?
N-methylmethanamine;N-(trifluoromethylsulfonyl)sulfamoyl fluoride has a molecular weight of 276.23 g/mol, XLogP of -0.52, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylmethanamine;N-(trifluoromethylsulfonyl)sulfamoyl fluoride is sourced from PubChem (CID 118659705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).