5-(furan-2-ylmethylsulfanyl)-1,3-thiazol-2-amine

C8H8N2OS2 — CID 43243212

IUPAC5-(furan-2-ylmethylsulfanyl)-1,3-thiazol-2-amine
SMILESNc1ncc(SCc2ccco2)s1
InChIInChI=1S/C8H8N2OS2/c9-8-10-4-7(13-8)12-5-6-2-1-3-11-6/h1-4H,5H2,(H2,9,10)
InChIKeyOZJPIXUGTHVGDR-UHFFFAOYSA-N
MW212.30 g/mol
LogP2.61
Rot. Bonds3

About 5-(furan-2-ylmethylsulfanyl)-1,3-thiazol-2-amine

5-(furan-2-ylmethylsulfanyl)-1,3-thiazol-2-amine (PubChem CID 43243212) has the molecular formula C8H8N2OS2 and a molecular weight of 212.30 g/mol. Its IUPAC name is 5-(furan-2-ylmethylsulfanyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-(furan-2-ylmethylsulfanyl)-1,3-thiazol-2-amine
PubChem CID43243212
Molecular FormulaC8H8N2OS2
Molecular Weight212.30 g/mol
Exact Mass212.01
IUPAC Name5-(furan-2-ylmethylsulfanyl)-1,3-thiazol-2-amine
SMILESNc1ncc(SCc2ccco2)s1
InChIInChI=1S/C8H8N2OS2/c9-8-10-4-7(13-8)12-5-6-2-1-3-11-6/h1-4H,5H2,(H2,9,10)
InChIKeyOZJPIXUGTHVGDR-UHFFFAOYSA-N
XLogP2.61
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.30
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(furan-2-ylmethylsulfanyl)-1,3-thiazol-2-amine?
The IUPAC name of 5-(furan-2-ylmethylsulfanyl)-1,3-thiazol-2-amine (CID 43243212) is 5-(furan-2-ylmethylsulfanyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 5-(furan-2-ylmethylsulfanyl)-1,3-thiazol-2-amine?
The canonical SMILES for 5-(furan-2-ylmethylsulfanyl)-1,3-thiazol-2-amine is Nc1ncc(SCc2ccco2)s1.
What is the InChIKey of 5-(furan-2-ylmethylsulfanyl)-1,3-thiazol-2-amine?
The InChIKey is OZJPIXUGTHVGDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2OS2/c9-8-10-4-7(13-8)12-5-6-2-1-3-11-6/h1-4H,5H2,(H2,9,10).
What are the key properties of 5-(furan-2-ylmethylsulfanyl)-1,3-thiazol-2-amine?
5-(furan-2-ylmethylsulfanyl)-1,3-thiazol-2-amine has a molecular weight of 212.30 g/mol, XLogP of 2.61, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(furan-2-ylmethylsulfanyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 43243212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).