N-(4-methylcyclohexyl)-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide

C₁₄H₂₃N₃O₃ — CID 154796898

About N-(4-methylcyclohexyl)-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide

N-(4-methylcyclohexyl)-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide (PubChem CID 154796898) has the molecular formula C₁₄H₂₃N₃O₃ and a molecular weight of 281.36 g/mol. Its IUPAC name is N-(4-methylcyclohexyl)-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide.

Molecular Properties

• Compound Name: N-(4-methylcyclohexyl)-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide
• PubChem CID: 154796898
• Molecular Formula: C₁₄H₂₃N₃O₃
• Molecular Weight: 281.36 g/mol
• Exact Mass: 281.17
• IUPAC Name: N-(4-methylcyclohexyl)-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide
• SMILES: CC1CCC(NC(=O)Cn2c(C(C)C)noc2=O)CC1
• InChI: InChI=1S/C14H23N3O3/c1-9(2)13-16-20-14(19)17(13)8-12(18)15-11-6-4-10(3)5-7-11/h9-11H,4-8H2,1-3H3,(H,15,18)
• InChIKey: YIDSNFDAIBOMPB-UHFFFAOYSA-N
• XLogP: 1.65
• TPSA: 77.13 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 4
• Heavy Atoms: 20
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	281.36
LogP ≤ 5	1.65
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-(4-methylcyclohexyl)-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide?

The IUPAC name of N-(4-methylcyclohexyl)-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide (CID 154796898) is N-(4-methylcyclohexyl)-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide.

What is the SMILES notation for N-(4-methylcyclohexyl)-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide?

The canonical SMILES for N-(4-methylcyclohexyl)-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide is CC1CCC(NC(=O)Cn2c(C(C)C)noc2=O)CC1.

What is the InChIKey of N-(4-methylcyclohexyl)-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide?

The InChIKey is YIDSNFDAIBOMPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O3/c1-9(2)13-16-20-14(19)17(13)8-12(18)15-11-6-4-10(3)5-7-11/h9-11H,4-8H2,1-3H3,(H,15,18).

What are the key properties of N-(4-methylcyclohexyl)-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide?

N-(4-methylcyclohexyl)-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide has a molecular weight of 281.36 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-(4-methylcyclohexyl)-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide is sourced from PubChem (CID 154796898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 154796898 — identifiers, structure, computed properties (public domain)

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