1-[5-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclopentan-1-amine

C15H16N4O2S — CID 120855275

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

1-[5-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclopentan-1-amine (PubChem CID 120855275) has the molecular formula C15H16N4O2S and a molecular weight of 316.39 g/mol. Its IUPAC name is 1-[5-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclopentan-1-amine.

Molecular Properties

• Compound Name: 1-[5-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclopentan-1-amine
• PubChem CID: 120855275
• Molecular Formula: C15H16N4O2S
• Molecular Weight: 316.39 g/mol
• Exact Mass: 316.10
• IUPAC Name: 1-[5-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclopentan-1-amine
• SMILES: Cc1ccc(-c2nc(-c3nc(C4(N)CCCC4)no3)cs2)o1
• InChI: InChI=1S/C15H16N4O2S/c1-9-4-5-11(20-9)13-17-10(8-22-13)12-18-14(19-21-12)15(16)6-2-3-7-15/h4-5,8H,2-3,6-7,16H2,1H3
• InChIKey: ASAUKIDJBFGXDM-UHFFFAOYSA-N
• XLogP: 3.49
• TPSA: 90.97 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 3
• Heavy Atoms: 22
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	316.39
LogP ≤ 5	3.49
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 1-[5-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclopentan-1-amine?

The IUPAC name of 1-[5-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclopentan-1-amine (CID 120855275) is 1-[5-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclopentan-1-amine.

What is the SMILES notation for 1-[5-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclopentan-1-amine?

The canonical SMILES for 1-[5-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclopentan-1-amine is Cc1ccc(-c2nc(-c3nc(C4(N)CCCC4)no3)cs2)o1.

What is the InChIKey of 1-[5-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclopentan-1-amine?

The InChIKey is ASAUKIDJBFGXDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O2S/c1-9-4-5-11(20-9)13-17-10(8-22-13)12-18-14(19-21-12)15(16)6-2-3-7-15/h4-5,8H,2-3,6-7,16H2,1H3.

What are the key properties of 1-[5-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclopentan-1-amine?

1-[5-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclopentan-1-amine has a molecular weight of 316.39 g/mol, XLogP of 3.49, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[5-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclopentan-1-amine is sourced from PubChem (CID 120855275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).