(E)-but-1-ene-1-sulfonamide

C4H9NO2S — CID 18315564

IUPAC(E)-but-1-ene-1-sulfonamide
SMILESCC/C=C/S(N)(=O)=O
InChIInChI=1S/C4H9NO2S/c1-2-3-4-8(5,6)7/h3-4H,2H2,1H3,(H2,5,6,7)/b4-3+
InChIKeyPERZKGSNLVHXQK-ONEGZZNKSA-N
MW135.19 g/mol
LogP0.20
Rot. Bonds2

About (E)-but-1-ene-1-sulfonamide

(E)-but-1-ene-1-sulfonamide (PubChem CID 18315564) has the molecular formula C4H9NO2S and a molecular weight of 135.19 g/mol. Its IUPAC name is (E)-but-1-ene-1-sulfonamide.

Molecular Properties

Compound Name(E)-but-1-ene-1-sulfonamide
PubChem CID18315564
Molecular FormulaC4H9NO2S
Molecular Weight135.19 g/mol
Exact Mass135.04
IUPAC Name(E)-but-1-ene-1-sulfonamide
SMILESCC/C=C/S(N)(=O)=O
InChIInChI=1S/C4H9NO2S/c1-2-3-4-8(5,6)7/h3-4H,2H2,1H3,(H2,5,6,7)/b4-3+
InChIKeyPERZKGSNLVHXQK-ONEGZZNKSA-N
XLogP0.20
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.19
LogP ≤ 50.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (E)-but-1-ene-1-sulfonamide 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)-but-1-ene-1-sulfonamide?
The IUPAC name of (E)-but-1-ene-1-sulfonamide (CID 18315564) is (E)-but-1-ene-1-sulfonamide.
What is the SMILES notation for (E)-but-1-ene-1-sulfonamide?
The canonical SMILES for (E)-but-1-ene-1-sulfonamide is CC/C=C/S(N)(=O)=O.
What is the InChIKey of (E)-but-1-ene-1-sulfonamide?
The InChIKey is PERZKGSNLVHXQK-ONEGZZNKSA-N. The full InChI is InChI=1S/C4H9NO2S/c1-2-3-4-8(5,6)7/h3-4H,2H2,1H3,(H2,5,6,7)/b4-3+.
What are the key properties of (E)-but-1-ene-1-sulfonamide?
(E)-but-1-ene-1-sulfonamide has a molecular weight of 135.19 g/mol, XLogP of 0.20, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-but-1-ene-1-sulfonamide is sourced from PubChem (CID 18315564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).