7,8-dihydronaphthalen-2-yl-[4-[3-(dimethylamino)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]methanone

C20H24N4O2 — CID 146124961

About 7,8-dihydronaphthalen-2-yl-[4-[3-(dimethylamino)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]methanone

7,8-dihydronaphthalen-2-yl-[4-[3-(dimethylamino)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]methanone (PubChem CID 146124961) has the molecular formula C20H24N4O2 and a molecular weight of 352.44 g/mol. Its IUPAC name is 7,8-dihydronaphthalen-2-yl-[4-[3-(dimethylamino)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]methanone.

Molecular Properties

• Compound Name: 7,8-dihydronaphthalen-2-yl-[4-[3-(dimethylamino)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]methanone
• PubChem CID: 146124961
• Molecular Formula: C20H24N4O2
• Molecular Weight: 352.44 g/mol
• Exact Mass: 352.19
• IUPAC Name: 7,8-dihydronaphthalen-2-yl-[4-[3-(dimethylamino)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]methanone
• SMILES: CN(C)c1noc(C2CCN(C(=O)c3ccc4c(c3)CCC=C4)CC2)n1
• InChI: InChI=1S/C20H24N4O2/c1-23(2)20-21-18(26-22-20)15-9-11-24(12-10-15)19(25)17-8-7-14-5-3-4-6-16(14)13-17/h3,5,7-8,13,15H,4,6,9-12H2,1-2H3
• InChIKey: WOPXYXJMQNDVLP-UHFFFAOYSA-N
• XLogP: 3.11
• TPSA: 62.47 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 3
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	352.44
LogP ≤ 5	3.11
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 7,8-dihydronaphthalen-2-yl-[4-[3-(dimethylamino)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]methanone?

The IUPAC name of 7,8-dihydronaphthalen-2-yl-[4-[3-(dimethylamino)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]methanone (CID 146124961) is 7,8-dihydronaphthalen-2-yl-[4-[3-(dimethylamino)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]methanone.

What is the SMILES notation for 7,8-dihydronaphthalen-2-yl-[4-[3-(dimethylamino)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]methanone?

The canonical SMILES for 7,8-dihydronaphthalen-2-yl-[4-[3-(dimethylamino)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]methanone is CN(C)c1noc(C2CCN(C(=O)c3ccc4c(c3)CCC=C4)CC2)n1.

What is the InChIKey of 7,8-dihydronaphthalen-2-yl-[4-[3-(dimethylamino)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]methanone?

The InChIKey is WOPXYXJMQNDVLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O2/c1-23(2)20-21-18(26-22-20)15-9-11-24(12-10-15)19(25)17-8-7-14-5-3-4-6-16(14)13-17/h3,5,7-8,13,15H,4,6,9-12H2,1-2H3.

What are the key properties of 7,8-dihydronaphthalen-2-yl-[4-[3-(dimethylamino)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]methanone?

7,8-dihydronaphthalen-2-yl-[4-[3-(dimethylamino)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]methanone has a molecular weight of 352.44 g/mol, XLogP of 3.11, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 7,8-dihydronaphthalen-2-yl-[4-[3-(dimethylamino)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]methanone is sourced from PubChem (CID 146124961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).