N-methyl-2-[5-(4-propan-2-ylthiadiazol-5-yl)-1,2,4-oxadiazol-3-yl]ethanamine

C₁₀H₁₅N₅OS — CID 65206378

About N-methyl-2-[5-(4-propan-2-ylthiadiazol-5-yl)-1,2,4-oxadiazol-3-yl]ethanamine

N-methyl-2-[5-(4-propan-2-ylthiadiazol-5-yl)-1,2,4-oxadiazol-3-yl]ethanamine (PubChem CID 65206378) has the molecular formula C₁₀H₁₅N₅OS and a molecular weight of 253.33 g/mol. Its IUPAC name is N-methyl-2-[5-(4-propan-2-ylthiadiazol-5-yl)-1,2,4-oxadiazol-3-yl]ethanamine.

Molecular Properties

• Compound Name: N-methyl-2-[5-(4-propan-2-ylthiadiazol-5-yl)-1,2,4-oxadiazol-3-yl]ethanamine
• PubChem CID: 65206378
• Molecular Formula: C₁₀H₁₅N₅OS
• Molecular Weight: 253.33 g/mol
• Exact Mass: 253.10
• IUPAC Name: N-methyl-2-[5-(4-propan-2-ylthiadiazol-5-yl)-1,2,4-oxadiazol-3-yl]ethanamine
• SMILES: CNCCc1noc(-c2snnc2C(C)C)n1
• InChI: InChI=1S/C10H15N5OS/c1-6(2)8-9(17-15-13-8)10-12-7(14-16-10)4-5-11-3/h6,11H,4-5H2,1-3H3
• InChIKey: HQMXLLKTXBRAAV-UHFFFAOYSA-N
• XLogP: 1.47
• TPSA: 76.73 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 5
• Heavy Atoms: 17
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	253.33
LogP ≤ 5	1.47
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[5-(4-propan-2-ylthiadiazol-5-yl)-1,2,4-oxadiazol-3-yl]ethanamine?

The IUPAC name of N-methyl-2-[5-(4-propan-2-ylthiadiazol-5-yl)-1,2,4-oxadiazol-3-yl]ethanamine (CID 65206378) is N-methyl-2-[5-(4-propan-2-ylthiadiazol-5-yl)-1,2,4-oxadiazol-3-yl]ethanamine.

What is the SMILES notation for N-methyl-2-[5-(4-propan-2-ylthiadiazol-5-yl)-1,2,4-oxadiazol-3-yl]ethanamine?

The canonical SMILES for N-methyl-2-[5-(4-propan-2-ylthiadiazol-5-yl)-1,2,4-oxadiazol-3-yl]ethanamine is CNCCc1noc(-c2snnc2C(C)C)n1.

What is the InChIKey of N-methyl-2-[5-(4-propan-2-ylthiadiazol-5-yl)-1,2,4-oxadiazol-3-yl]ethanamine?

The InChIKey is HQMXLLKTXBRAAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5OS/c1-6(2)8-9(17-15-13-8)10-12-7(14-16-10)4-5-11-3/h6,11H,4-5H2,1-3H3.

What are the key properties of N-methyl-2-[5-(4-propan-2-ylthiadiazol-5-yl)-1,2,4-oxadiazol-3-yl]ethanamine?

N-methyl-2-[5-(4-propan-2-ylthiadiazol-5-yl)-1,2,4-oxadiazol-3-yl]ethanamine has a molecular weight of 253.33 g/mol, XLogP of 1.47, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for N-methyl-2-[5-(4-propan-2-ylthiadiazol-5-yl)-1,2,4-oxadiazol-3-yl]ethanamine is sourced from PubChem (CID 65206378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 65206378 — identifiers, structure, computed properties (public domain)

How this page is built: methodology · editorial policy & corrections.