1-[2-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)-4-phenylpiperidin-1-yl]-2-oxoethyl]pyrimidin-2-one

C25H25N5O2 — CID 165421711

About 1-[2-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)-4-phenylpiperidin-1-yl]-2-oxoethyl]pyrimidin-2-one

1-[2-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)-4-phenylpiperidin-1-yl]-2-oxoethyl]pyrimidin-2-one (PubChem CID 165421711) has the molecular formula C25H25N5O2 and a molecular weight of 427.51 g/mol. Its IUPAC name is 1-[2-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)-4-phenylpiperidin-1-yl]-2-oxoethyl]pyrimidin-2-one.

Molecular Properties

• Compound Name: 1-[2-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)-4-phenylpiperidin-1-yl]-2-oxoethyl]pyrimidin-2-one
• PubChem CID: 165421711
• Molecular Formula: C25H25N5O2
• Molecular Weight: 427.51 g/mol
• Exact Mass: 427.20
• IUPAC Name: 1-[2-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)-4-phenylpiperidin-1-yl]-2-oxoethyl]pyrimidin-2-one
• SMILES: Cc1ccn2cc(C3(c4ccccc4)CCN(C(=O)Cn4cccnc4=O)CC3)nc2c1
• InChI: InChI=1S/C25H25N5O2/c1-19-8-13-29-17-21(27-22(29)16-19)25(20-6-3-2-4-7-20)9-14-28(15-10-25)23(31)18-30-12-5-11-26-24(30)32/h2-8,11-13,16-17H,9-10,14-15,18H2,1H3
• InChIKey: CNKNQJRTILCXIE-UHFFFAOYSA-N
• XLogP: 2.81
• TPSA: 72.50 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 4
• Heavy Atoms: 32
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	427.51
LogP ≤ 5	2.81
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 1-[2-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)-4-phenylpiperidin-1-yl]-2-oxoethyl]pyrimidin-2-one?

The IUPAC name of 1-[2-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)-4-phenylpiperidin-1-yl]-2-oxoethyl]pyrimidin-2-one (CID 165421711) is 1-[2-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)-4-phenylpiperidin-1-yl]-2-oxoethyl]pyrimidin-2-one.

What is the SMILES notation for 1-[2-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)-4-phenylpiperidin-1-yl]-2-oxoethyl]pyrimidin-2-one?

The canonical SMILES for 1-[2-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)-4-phenylpiperidin-1-yl]-2-oxoethyl]pyrimidin-2-one is Cc1ccn2cc(C3(c4ccccc4)CCN(C(=O)Cn4cccnc4=O)CC3)nc2c1.

What is the InChIKey of 1-[2-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)-4-phenylpiperidin-1-yl]-2-oxoethyl]pyrimidin-2-one?

The InChIKey is CNKNQJRTILCXIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25N5O2/c1-19-8-13-29-17-21(27-22(29)16-19)25(20-6-3-2-4-7-20)9-14-28(15-10-25)23(31)18-30-12-5-11-26-24(30)32/h2-8,11-13,16-17H,9-10,14-15,18H2,1H3.

What are the key properties of 1-[2-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)-4-phenylpiperidin-1-yl]-2-oxoethyl]pyrimidin-2-one?

1-[2-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)-4-phenylpiperidin-1-yl]-2-oxoethyl]pyrimidin-2-one has a molecular weight of 427.51 g/mol, XLogP of 2.81, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[2-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)-4-phenylpiperidin-1-yl]-2-oxoethyl]pyrimidin-2-one is sourced from PubChem (CID 165421711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).