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

C12H9N3OS — CID 23144699

IUPAC4-(furan-2-yl)-5-pyridin-2-yl-1,3-thiazol-2-amine
SMILESNc1nc(-c2ccco2)c(-c2ccccn2)s1
InChIInChI=1S/C12H9N3OS/c13-12-15-10(9-5-3-7-16-9)11(17-12)8-4-1-2-6-14-8/h1-7H,(H2,13,15)
InChIKeyRNVYCWBAPKJYFO-UHFFFAOYSA-N
MW243.29 g/mol
LogP3.05
Rot. Bonds2

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

4-(furan-2-yl)-5-pyridin-2-yl-1,3-thiazol-2-amine (PubChem CID 23144699) has the molecular formula C12H9N3OS and a molecular weight of 243.29 g/mol. Its IUPAC name is 4-(furan-2-yl)-5-pyridin-2-yl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(furan-2-yl)-5-pyridin-2-yl-1,3-thiazol-2-amine
PubChem CID23144699
Molecular FormulaC12H9N3OS
Molecular Weight243.29 g/mol
Exact Mass243.05
IUPAC Name4-(furan-2-yl)-5-pyridin-2-yl-1,3-thiazol-2-amine
SMILESNc1nc(-c2ccco2)c(-c2ccccn2)s1
InChIInChI=1S/C12H9N3OS/c13-12-15-10(9-5-3-7-16-9)11(17-12)8-4-1-2-6-14-8/h1-7H,(H2,13,15)
InChIKeyRNVYCWBAPKJYFO-UHFFFAOYSA-N
XLogP3.05
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.29
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(furan-2-yl)-5-pyridin-2-yl-1,3-thiazol-2-amine?
The IUPAC name of 4-(furan-2-yl)-5-pyridin-2-yl-1,3-thiazol-2-amine (CID 23144699) is 4-(furan-2-yl)-5-pyridin-2-yl-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(furan-2-yl)-5-pyridin-2-yl-1,3-thiazol-2-amine?
The canonical SMILES for 4-(furan-2-yl)-5-pyridin-2-yl-1,3-thiazol-2-amine is Nc1nc(-c2ccco2)c(-c2ccccn2)s1.
What is the InChIKey of 4-(furan-2-yl)-5-pyridin-2-yl-1,3-thiazol-2-amine?
The InChIKey is RNVYCWBAPKJYFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9N3OS/c13-12-15-10(9-5-3-7-16-9)11(17-12)8-4-1-2-6-14-8/h1-7H,(H2,13,15).
What are the key properties of 4-(furan-2-yl)-5-pyridin-2-yl-1,3-thiazol-2-amine?
4-(furan-2-yl)-5-pyridin-2-yl-1,3-thiazol-2-amine has a molecular weight of 243.29 g/mol, XLogP of 3.05, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(furan-2-yl)-5-pyridin-2-yl-1,3-thiazol-2-amine is sourced from PubChem (CID 23144699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).