(E)-2-(methylamino)ethenesulfonyl fluoride

C3H6FNO2S — CID 170359155

IUPAC(E)-2-(methylamino)ethenesulfonyl fluoride
SMILESCN/C=C/S(=O)(=O)F
InChIInChI=1S/C3H6FNO2S/c1-5-2-3-8(4,6)7/h2-3,5H,1H3/b3-2+
InChIKeyNWWQYSXQQULZCE-NSCUHMNNSA-N
MW139.15 g/mol
LogP-0.02
Rot. Bonds2

About (E)-2-(methylamino)ethenesulfonyl fluoride

(E)-2-(methylamino)ethenesulfonyl fluoride (PubChem CID 170359155) has the molecular formula C3H6FNO2S and a molecular weight of 139.15 g/mol. Its IUPAC name is (E)-2-(methylamino)ethenesulfonyl fluoride.

Molecular Properties

Compound Name(E)-2-(methylamino)ethenesulfonyl fluoride
PubChem CID170359155
Molecular FormulaC3H6FNO2S
Molecular Weight139.15 g/mol
Exact Mass139.01
IUPAC Name(E)-2-(methylamino)ethenesulfonyl fluoride
SMILESCN/C=C/S(=O)(=O)F
InChIInChI=1S/C3H6FNO2S/c1-5-2-3-8(4,6)7/h2-3,5H,1H3/b3-2+
InChIKeyNWWQYSXQQULZCE-NSCUHMNNSA-N
XLogP-0.02
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.15
LogP ≤ 5-0.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (E)-2-(methylamino)ethenesulfonyl fluoride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (E)-2-(methylamino)ethenesulfonyl fluoride?
The IUPAC name of (E)-2-(methylamino)ethenesulfonyl fluoride (CID 170359155) is (E)-2-(methylamino)ethenesulfonyl fluoride.
What is the SMILES notation for (E)-2-(methylamino)ethenesulfonyl fluoride?
The canonical SMILES for (E)-2-(methylamino)ethenesulfonyl fluoride is CN/C=C/S(=O)(=O)F.
What is the InChIKey of (E)-2-(methylamino)ethenesulfonyl fluoride?
The InChIKey is NWWQYSXQQULZCE-NSCUHMNNSA-N. The full InChI is InChI=1S/C3H6FNO2S/c1-5-2-3-8(4,6)7/h2-3,5H,1H3/b3-2+.
What are the key properties of (E)-2-(methylamino)ethenesulfonyl fluoride?
(E)-2-(methylamino)ethenesulfonyl fluoride has a molecular weight of 139.15 g/mol, XLogP of -0.02, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-(methylamino)ethenesulfonyl fluoride is sourced from PubChem (CID 170359155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).