2-methyl-1-[(3R)-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]propan-1-one

C15H19N3O2S — CID 51895985

About 2-methyl-1-[(3R)-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]propan-1-one

2-methyl-1-[(3R)-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]propan-1-one (PubChem CID 51895985) has the molecular formula C15H19N3O2S and a molecular weight of 305.40 g/mol. Its IUPAC name is 2-methyl-1-[(3R)-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]propan-1-one.

Molecular Properties

• Compound Name: 2-methyl-1-[(3R)-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]propan-1-one
• PubChem CID: 51895985
• Molecular Formula: C15H19N3O2S
• Molecular Weight: 305.40 g/mol
• Exact Mass: 305.12
• IUPAC Name: 2-methyl-1-[(3R)-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]propan-1-one
• SMILES: CC(C)C(=O)N1CCC[C@@H](c2nnc(-c3cccs3)o2)C1
• InChI: InChI=1S/C15H19N3O2S/c1-10(2)15(19)18-7-3-5-11(9-18)13-16-17-14(20-13)12-6-4-8-21-12/h4,6,8,10-11H,3,5,7,9H2,1-2H3/t11-/m1/s1
• InChIKey: FJUAWRNBAMVRAV-LLVKDONJSA-N
• XLogP: 3.16
• TPSA: 59.23 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 3
• Heavy Atoms: 21
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	305.40
LogP ≤ 5	3.16
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-[(3R)-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]propan-1-one?

The IUPAC name of 2-methyl-1-[(3R)-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]propan-1-one (CID 51895985) is 2-methyl-1-[(3R)-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]propan-1-one.

What is the SMILES notation for 2-methyl-1-[(3R)-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]propan-1-one?

The canonical SMILES for 2-methyl-1-[(3R)-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]propan-1-one is CC(C)C(=O)N1CCC[C@@H](c2nnc(-c3cccs3)o2)C1.

What is the InChIKey of 2-methyl-1-[(3R)-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]propan-1-one?

The InChIKey is FJUAWRNBAMVRAV-LLVKDONJSA-N. The full InChI is InChI=1S/C15H19N3O2S/c1-10(2)15(19)18-7-3-5-11(9-18)13-16-17-14(20-13)12-6-4-8-21-12/h4,6,8,10-11H,3,5,7,9H2,1-2H3/t11-/m1/s1.

What are the key properties of 2-methyl-1-[(3R)-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]propan-1-one?

2-methyl-1-[(3R)-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]propan-1-one has a molecular weight of 305.40 g/mol, XLogP of 3.16, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-methyl-1-[(3R)-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]propan-1-one is sourced from PubChem (CID 51895985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).