1-[2-methyl-5-[3-[(1-methylpiperidin-4-yl)methyl]-1,2,4-oxadiazol-5-yl]phenyl]imidazolidin-2-one

C19H25N5O2 — CID 72900095

About 1-[2-methyl-5-[3-[(1-methylpiperidin-4-yl)methyl]-1,2,4-oxadiazol-5-yl]phenyl]imidazolidin-2-one

1-[2-methyl-5-[3-[(1-methylpiperidin-4-yl)methyl]-1,2,4-oxadiazol-5-yl]phenyl]imidazolidin-2-one (PubChem CID 72900095) has the molecular formula C19H25N5O2 and a molecular weight of 355.44 g/mol. Its IUPAC name is 1-[2-methyl-5-[3-[(1-methylpiperidin-4-yl)methyl]-1,2,4-oxadiazol-5-yl]phenyl]imidazolidin-2-one.

Molecular Properties

• Compound Name: 1-[2-methyl-5-[3-[(1-methylpiperidin-4-yl)methyl]-1,2,4-oxadiazol-5-yl]phenyl]imidazolidin-2-one
• PubChem CID: 72900095
• Molecular Formula: C19H25N5O2
• Molecular Weight: 355.44 g/mol
• Exact Mass: 355.20
• IUPAC Name: 1-[2-methyl-5-[3-[(1-methylpiperidin-4-yl)methyl]-1,2,4-oxadiazol-5-yl]phenyl]imidazolidin-2-one
• SMILES: Cc1ccc(-c2nc(CC3CCN(C)CC3)no2)cc1N1CCNC1=O
• InChI: InChI=1S/C19H25N5O2/c1-13-3-4-15(12-16(13)24-10-7-20-19(24)25)18-21-17(22-26-18)11-14-5-8-23(2)9-6-14/h3-4,12,14H,5-11H2,1-2H3,(H,20,25)
• InChIKey: COYXPNDXYWCSCA-UHFFFAOYSA-N
• XLogP: 2.46
• TPSA: 74.50 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 4
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	355.44
LogP ≤ 5	2.46
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 1-[2-methyl-5-[3-[(1-methylpiperidin-4-yl)methyl]-1,2,4-oxadiazol-5-yl]phenyl]imidazolidin-2-one?

The IUPAC name of 1-[2-methyl-5-[3-[(1-methylpiperidin-4-yl)methyl]-1,2,4-oxadiazol-5-yl]phenyl]imidazolidin-2-one (CID 72900095) is 1-[2-methyl-5-[3-[(1-methylpiperidin-4-yl)methyl]-1,2,4-oxadiazol-5-yl]phenyl]imidazolidin-2-one.

What is the SMILES notation for 1-[2-methyl-5-[3-[(1-methylpiperidin-4-yl)methyl]-1,2,4-oxadiazol-5-yl]phenyl]imidazolidin-2-one?

The canonical SMILES for 1-[2-methyl-5-[3-[(1-methylpiperidin-4-yl)methyl]-1,2,4-oxadiazol-5-yl]phenyl]imidazolidin-2-one is Cc1ccc(-c2nc(CC3CCN(C)CC3)no2)cc1N1CCNC1=O.

What is the InChIKey of 1-[2-methyl-5-[3-[(1-methylpiperidin-4-yl)methyl]-1,2,4-oxadiazol-5-yl]phenyl]imidazolidin-2-one?

The InChIKey is COYXPNDXYWCSCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O2/c1-13-3-4-15(12-16(13)24-10-7-20-19(24)25)18-21-17(22-26-18)11-14-5-8-23(2)9-6-14/h3-4,12,14H,5-11H2,1-2H3,(H,20,25).

What are the key properties of 1-[2-methyl-5-[3-[(1-methylpiperidin-4-yl)methyl]-1,2,4-oxadiazol-5-yl]phenyl]imidazolidin-2-one?

1-[2-methyl-5-[3-[(1-methylpiperidin-4-yl)methyl]-1,2,4-oxadiazol-5-yl]phenyl]imidazolidin-2-one has a molecular weight of 355.44 g/mol, XLogP of 2.46, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[2-methyl-5-[3-[(1-methylpiperidin-4-yl)methyl]-1,2,4-oxadiazol-5-yl]phenyl]imidazolidin-2-one is sourced from PubChem (CID 72900095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).