2-amino-N-(1,3-thiazol-2-yl)ethanesulfonamide

C5H9N3O2S2 — CID 16784506

IUPAC2-amino-N-(1,3-thiazol-2-yl)ethanesulfonamide
SMILESNCCS(=O)(=O)Nc1nccs1
InChIInChI=1S/C5H9N3O2S2/c6-1-4-12(9,10)8-5-7-2-3-11-5/h2-3H,1,4,6H2,(H,7,8)
InChIKeyICSQPJCCYSXHFI-UHFFFAOYSA-N
MW207.28 g/mol
LogP-0.16
Rot. Bonds4

About 2-amino-N-(1,3-thiazol-2-yl)ethanesulfonamide

2-amino-N-(1,3-thiazol-2-yl)ethanesulfonamide (PubChem CID 16784506) has the molecular formula C5H9N3O2S2 and a molecular weight of 207.28 g/mol. Its IUPAC name is 2-amino-N-(1,3-thiazol-2-yl)ethanesulfonamide.

Molecular Properties

Compound Name2-amino-N-(1,3-thiazol-2-yl)ethanesulfonamide
PubChem CID16784506
Molecular FormulaC5H9N3O2S2
Molecular Weight207.28 g/mol
Exact Mass207.01
IUPAC Name2-amino-N-(1,3-thiazol-2-yl)ethanesulfonamide
SMILESNCCS(=O)(=O)Nc1nccs1
InChIInChI=1S/C5H9N3O2S2/c6-1-4-12(9,10)8-5-7-2-3-11-5/h2-3H,1,4,6H2,(H,7,8)
InChIKeyICSQPJCCYSXHFI-UHFFFAOYSA-N
XLogP-0.16
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 5-0.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1,3-thiazol-2-yl)ethanesulfonamide?
The IUPAC name of 2-amino-N-(1,3-thiazol-2-yl)ethanesulfonamide (CID 16784506) is 2-amino-N-(1,3-thiazol-2-yl)ethanesulfonamide.
What is the SMILES notation for 2-amino-N-(1,3-thiazol-2-yl)ethanesulfonamide?
The canonical SMILES for 2-amino-N-(1,3-thiazol-2-yl)ethanesulfonamide is NCCS(=O)(=O)Nc1nccs1.
What is the InChIKey of 2-amino-N-(1,3-thiazol-2-yl)ethanesulfonamide?
The InChIKey is ICSQPJCCYSXHFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N3O2S2/c6-1-4-12(9,10)8-5-7-2-3-11-5/h2-3H,1,4,6H2,(H,7,8).
What are the key properties of 2-amino-N-(1,3-thiazol-2-yl)ethanesulfonamide?
2-amino-N-(1,3-thiazol-2-yl)ethanesulfonamide has a molecular weight of 207.28 g/mol, XLogP of -0.16, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1,3-thiazol-2-yl)ethanesulfonamide is sourced from PubChem (CID 16784506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).