3-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-N-[2-(2-methyl-1,3-thiazol-5-yl)ethyl]piperidine-1-carboxamide

C16H23N5O2S — CID 138022982

About 3-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-N-[2-(2-methyl-1,3-thiazol-5-yl)ethyl]piperidine-1-carboxamide

3-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-N-[2-(2-methyl-1,3-thiazol-5-yl)ethyl]piperidine-1-carboxamide (PubChem CID 138022982) has the molecular formula C16H23N5O2S and a molecular weight of 349.46 g/mol. Its IUPAC name is 3-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-N-[2-(2-methyl-1,3-thiazol-5-yl)ethyl]piperidine-1-carboxamide.

Molecular Properties

• Compound Name: 3-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-N-[2-(2-methyl-1,3-thiazol-5-yl)ethyl]piperidine-1-carboxamide
• PubChem CID: 138022982
• Molecular Formula: C16H23N5O2S
• Molecular Weight: 349.46 g/mol
• Exact Mass: 349.16
• IUPAC Name: 3-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-N-[2-(2-methyl-1,3-thiazol-5-yl)ethyl]piperidine-1-carboxamide
• SMILES: Cc1noc(CC2CCCN(C(=O)NCCc3cnc(C)s3)C2)n1
• InChI: InChI=1S/C16H23N5O2S/c1-11-19-15(23-20-11)8-13-4-3-7-21(10-13)16(22)17-6-5-14-9-18-12(2)24-14/h9,13H,3-8,10H2,1-2H3,(H,17,22)
• InChIKey: BLECKPYWFJRYFK-UHFFFAOYSA-N
• XLogP: 2.35
• TPSA: 84.15 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 5
• Heavy Atoms: 24
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	349.46
LogP ≤ 5	2.35
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 3-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-N-[2-(2-methyl-1,3-thiazol-5-yl)ethyl]piperidine-1-carboxamide?

The IUPAC name of 3-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-N-[2-(2-methyl-1,3-thiazol-5-yl)ethyl]piperidine-1-carboxamide (CID 138022982) is 3-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-N-[2-(2-methyl-1,3-thiazol-5-yl)ethyl]piperidine-1-carboxamide.

What is the SMILES notation for 3-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-N-[2-(2-methyl-1,3-thiazol-5-yl)ethyl]piperidine-1-carboxamide?

The canonical SMILES for 3-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-N-[2-(2-methyl-1,3-thiazol-5-yl)ethyl]piperidine-1-carboxamide is Cc1noc(CC2CCCN(C(=O)NCCc3cnc(C)s3)C2)n1.

What is the InChIKey of 3-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-N-[2-(2-methyl-1,3-thiazol-5-yl)ethyl]piperidine-1-carboxamide?

The InChIKey is BLECKPYWFJRYFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N5O2S/c1-11-19-15(23-20-11)8-13-4-3-7-21(10-13)16(22)17-6-5-14-9-18-12(2)24-14/h9,13H,3-8,10H2,1-2H3,(H,17,22).

What are the key properties of 3-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-N-[2-(2-methyl-1,3-thiazol-5-yl)ethyl]piperidine-1-carboxamide?

3-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-N-[2-(2-methyl-1,3-thiazol-5-yl)ethyl]piperidine-1-carboxamide has a molecular weight of 349.46 g/mol, XLogP of 2.35, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-N-[2-(2-methyl-1,3-thiazol-5-yl)ethyl]piperidine-1-carboxamide is sourced from PubChem (CID 138022982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).