cyclopentyl-[4-[5-methyl-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]piperazin-1-yl]methanone;molecular hydrogen

C23H28N6O2 — CID 159001872

About cyclopentyl-[4-[5-methyl-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]piperazin-1-yl]methanone;molecular hydrogen

cyclopentyl-[4-[5-methyl-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]piperazin-1-yl]methanone;molecular hydrogen (PubChem CID 159001872) has the molecular formula C23H28N6O2 and a molecular weight of 420.52 g/mol. Its IUPAC name is cyclopentyl-[4-[5-methyl-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]piperazin-1-yl]methanone;molecular hydrogen.

Molecular Properties

• Compound Name: cyclopentyl-[4-[5-methyl-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]piperazin-1-yl]methanone;molecular hydrogen
• PubChem CID: 159001872
• Molecular Formula: C23H28N6O2
• Molecular Weight: 420.52 g/mol
• Exact Mass: 420.23
• IUPAC Name: cyclopentyl-[4-[5-methyl-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]piperazin-1-yl]methanone;molecular hydrogen
• SMILES: Cc1ncc(N2CCN(C(=O)C3CCCC3)CC2)nc1-c1nnc(-c2ccccc2)o1.[H][H]
• InChI: InChI=1S/C23H26N6O2.H2/c1-16-20(22-27-26-21(31-22)17-7-3-2-4-8-17)25-19(15-24-16)28-11-13-29(14-12-28)23(30)18-9-5-6-10-18;/h2-4,7-8,15,18H,5-6,9-14H2,1H3;1H
• InChIKey: JRKZLWQOJXZKJY-UHFFFAOYSA-N
• XLogP: 3.59
• TPSA: 88.25 Ų
• H-Bond Acceptors: 7
• Rotatable Bonds: 4
• Heavy Atoms: 31
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	420.52
LogP ≤ 5	3.59
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of cyclopentyl-[4-[5-methyl-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]piperazin-1-yl]methanone;molecular hydrogen?

The IUPAC name of cyclopentyl-[4-[5-methyl-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]piperazin-1-yl]methanone;molecular hydrogen (CID 159001872) is cyclopentyl-[4-[5-methyl-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]piperazin-1-yl]methanone;molecular hydrogen.

What is the SMILES notation for cyclopentyl-[4-[5-methyl-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]piperazin-1-yl]methanone;molecular hydrogen?

The canonical SMILES for cyclopentyl-[4-[5-methyl-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]piperazin-1-yl]methanone;molecular hydrogen is Cc1ncc(N2CCN(C(=O)C3CCCC3)CC2)nc1-c1nnc(-c2ccccc2)o1.[H][H].

What is the InChIKey of cyclopentyl-[4-[5-methyl-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]piperazin-1-yl]methanone;molecular hydrogen?

The InChIKey is JRKZLWQOJXZKJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N6O2.H2/c1-16-20(22-27-26-21(31-22)17-7-3-2-4-8-17)25-19(15-24-16)28-11-13-29(14-12-28)23(30)18-9-5-6-10-18;/h2-4,7-8,15,18H,5-6,9-14H2,1H3;1H.

What are the key properties of cyclopentyl-[4-[5-methyl-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]piperazin-1-yl]methanone;molecular hydrogen?

cyclopentyl-[4-[5-methyl-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]piperazin-1-yl]methanone;molecular hydrogen has a molecular weight of 420.52 g/mol, XLogP of 3.59, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for cyclopentyl-[4-[5-methyl-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]piperazin-1-yl]methanone;molecular hydrogen is sourced from PubChem (CID 159001872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).