4,5-bis(furan-2-yl)-1,3-thiazol-2-amine

C11H8N2O2S — CID 2428993

IUPAC4,5-bis(furan-2-yl)-1,3-thiazol-2-amine
SMILESNc1nc(-c2ccco2)c(-c2ccco2)s1
InChIInChI=1S/C11H8N2O2S/c12-11-13-9(7-3-1-5-14-7)10(16-11)8-4-2-6-15-8/h1-6H,(H2,12,13)
InChIKeyQEWXZBHBTDAGQC-UHFFFAOYSA-N
MW232.26 g/mol
LogP3.25
Rot. Bonds2

About 4,5-bis(furan-2-yl)-1,3-thiazol-2-amine

4,5-bis(furan-2-yl)-1,3-thiazol-2-amine (PubChem CID 2428993) has the molecular formula C11H8N2O2S and a molecular weight of 232.26 g/mol. Its IUPAC name is 4,5-bis(furan-2-yl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4,5-bis(furan-2-yl)-1,3-thiazol-2-amine
PubChem CID2428993
Molecular FormulaC11H8N2O2S
Molecular Weight232.26 g/mol
Exact Mass232.03
IUPAC Name4,5-bis(furan-2-yl)-1,3-thiazol-2-amine
SMILESNc1nc(-c2ccco2)c(-c2ccco2)s1
InChIInChI=1S/C11H8N2O2S/c12-11-13-9(7-3-1-5-14-7)10(16-11)8-4-2-6-15-8/h1-6H,(H2,12,13)
InChIKeyQEWXZBHBTDAGQC-UHFFFAOYSA-N
XLogP3.25
TPSA65.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.26
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4,5-bis(furan-2-yl)-1,3-thiazol-2-amine?
The IUPAC name of 4,5-bis(furan-2-yl)-1,3-thiazol-2-amine (CID 2428993) is 4,5-bis(furan-2-yl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4,5-bis(furan-2-yl)-1,3-thiazol-2-amine?
The canonical SMILES for 4,5-bis(furan-2-yl)-1,3-thiazol-2-amine is Nc1nc(-c2ccco2)c(-c2ccco2)s1.
What is the InChIKey of 4,5-bis(furan-2-yl)-1,3-thiazol-2-amine?
The InChIKey is QEWXZBHBTDAGQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N2O2S/c12-11-13-9(7-3-1-5-14-7)10(16-11)8-4-2-6-15-8/h1-6H,(H2,12,13).
What are the key properties of 4,5-bis(furan-2-yl)-1,3-thiazol-2-amine?
4,5-bis(furan-2-yl)-1,3-thiazol-2-amine has a molecular weight of 232.26 g/mol, XLogP of 3.25, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-bis(furan-2-yl)-1,3-thiazol-2-amine is sourced from PubChem (CID 2428993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).