2-(1,3-thiazol-2-yl)ethenesulfonamide

C5H6N2O2S2 — CID 171034875

IUPAC2-(1,3-thiazol-2-yl)ethenesulfonamide
SMILESNS(=O)(=O)C=Cc1nccs1
InChIInChI=1S/C5H6N2O2S2/c6-11(8,9)4-1-5-7-2-3-10-5/h1-4H,(H2,6,8,9)
InChIKeyPGHAEEZPOUYNMQ-UHFFFAOYSA-N
MW190.25 g/mol
LogP0.40
Rot. Bonds2

About 2-(1,3-thiazol-2-yl)ethenesulfonamide

2-(1,3-thiazol-2-yl)ethenesulfonamide (PubChem CID 171034875) has the molecular formula C5H6N2O2S2 and a molecular weight of 190.25 g/mol. Its IUPAC name is 2-(1,3-thiazol-2-yl)ethenesulfonamide.

Molecular Properties

Compound Name2-(1,3-thiazol-2-yl)ethenesulfonamide
PubChem CID171034875
Molecular FormulaC5H6N2O2S2
Molecular Weight190.25 g/mol
Exact Mass189.99
IUPAC Name2-(1,3-thiazol-2-yl)ethenesulfonamide
SMILESNS(=O)(=O)C=Cc1nccs1
InChIInChI=1S/C5H6N2O2S2/c6-11(8,9)4-1-5-7-2-3-10-5/h1-4H,(H2,6,8,9)
InChIKeyPGHAEEZPOUYNMQ-UHFFFAOYSA-N
XLogP0.40
TPSA73.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(1,3-thiazol-2-yl)ethenesulfonamide?
The IUPAC name of 2-(1,3-thiazol-2-yl)ethenesulfonamide (CID 171034875) is 2-(1,3-thiazol-2-yl)ethenesulfonamide.
What is the SMILES notation for 2-(1,3-thiazol-2-yl)ethenesulfonamide?
The canonical SMILES for 2-(1,3-thiazol-2-yl)ethenesulfonamide is NS(=O)(=O)C=Cc1nccs1.
What is the InChIKey of 2-(1,3-thiazol-2-yl)ethenesulfonamide?
The InChIKey is PGHAEEZPOUYNMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N2O2S2/c6-11(8,9)4-1-5-7-2-3-10-5/h1-4H,(H2,6,8,9).
What are the key properties of 2-(1,3-thiazol-2-yl)ethenesulfonamide?
2-(1,3-thiazol-2-yl)ethenesulfonamide has a molecular weight of 190.25 g/mol, XLogP of 0.40, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-thiazol-2-yl)ethenesulfonamide is sourced from PubChem (CID 171034875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).