5-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-4-methyl-1,3-thiazol-2-amine

C10H8N4O2S — CID 62794151

IUPAC5-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-4-methyl-1,3-thiazol-2-amine
SMILESCc1nc(N)sc1-c1nc(-c2ccco2)no1
InChIInChI=1S/C10H8N4O2S/c1-5-7(17-10(11)12-5)9-13-8(14-16-9)6-3-2-4-15-6/h2-4H,1H3,(H2,11,12)
InChIKeyGTQSINNCCXWJCE-UHFFFAOYSA-N
MW248.27 g/mol
LogP2.34
Rot. Bonds2

About 5-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-4-methyl-1,3-thiazol-2-amine

5-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-4-methyl-1,3-thiazol-2-amine (PubChem CID 62794151) has the molecular formula C10H8N4O2S and a molecular weight of 248.27 g/mol. Its IUPAC name is 5-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-4-methyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-4-methyl-1,3-thiazol-2-amine
PubChem CID62794151
Molecular FormulaC10H8N4O2S
Molecular Weight248.27 g/mol
Exact Mass248.04
IUPAC Name5-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-4-methyl-1,3-thiazol-2-amine
SMILESCc1nc(N)sc1-c1nc(-c2ccco2)no1
InChIInChI=1S/C10H8N4O2S/c1-5-7(17-10(11)12-5)9-13-8(14-16-9)6-3-2-4-15-6/h2-4H,1H3,(H2,11,12)
InChIKeyGTQSINNCCXWJCE-UHFFFAOYSA-N
XLogP2.34
TPSA90.97 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.27
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 5-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-4-methyl-1,3-thiazol-2-amine?
The IUPAC name of 5-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-4-methyl-1,3-thiazol-2-amine (CID 62794151) is 5-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-4-methyl-1,3-thiazol-2-amine.
What is the SMILES notation for 5-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-4-methyl-1,3-thiazol-2-amine?
The canonical SMILES for 5-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-4-methyl-1,3-thiazol-2-amine is Cc1nc(N)sc1-c1nc(-c2ccco2)no1.
What is the InChIKey of 5-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-4-methyl-1,3-thiazol-2-amine?
The InChIKey is GTQSINNCCXWJCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N4O2S/c1-5-7(17-10(11)12-5)9-13-8(14-16-9)6-3-2-4-15-6/h2-4H,1H3,(H2,11,12).
What are the key properties of 5-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-4-methyl-1,3-thiazol-2-amine?
5-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-4-methyl-1,3-thiazol-2-amine has a molecular weight of 248.27 g/mol, XLogP of 2.34, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-4-methyl-1,3-thiazol-2-amine is sourced from PubChem (CID 62794151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).