(8-methylimidazo[1,2-a]pyridin-2-yl)-[(2R)-2-[6-methyl-4-[(3-methylphenyl)methyl]-2-pyridinyl]pyrrolidin-1-yl]methanone

C27H28N4O — CID 92617149

About (8-methylimidazo[1,2-a]pyridin-2-yl)-[(2R)-2-[6-methyl-4-[(3-methylphenyl)methyl]-2-pyridinyl]pyrrolidin-1-yl]methanone

(8-methylimidazo[1,2-a]pyridin-2-yl)-[(2R)-2-[6-methyl-4-[(3-methylphenyl)methyl]-2-pyridinyl]pyrrolidin-1-yl]methanone (PubChem CID 92617149) has the molecular formula C27H28N4O and a molecular weight of 424.55 g/mol. Its IUPAC name is (8-methylimidazo[1,2-a]pyridin-2-yl)-[(2R)-2-[6-methyl-4-[(3-methylphenyl)methyl]-2-pyridinyl]pyrrolidin-1-yl]methanone.

Molecular Properties

• Compound Name: (8-methylimidazo[1,2-a]pyridin-2-yl)-[(2R)-2-[6-methyl-4-[(3-methylphenyl)methyl]-2-pyridinyl]pyrrolidin-1-yl]methanone
• PubChem CID: 92617149
• Molecular Formula: C27H28N4O
• Molecular Weight: 424.55 g/mol
• Exact Mass: 424.23
• IUPAC Name: (8-methylimidazo[1,2-a]pyridin-2-yl)-[(2R)-2-[6-methyl-4-[(3-methylphenyl)methyl]-2-pyridinyl]pyrrolidin-1-yl]methanone
• SMILES: Cc1cccc(Cc2cc(C)nc([C@H]3CCCN3C(=O)c3cn4cccc(C)c4n3)c2)c1
• InChI: InChI=1S/C27H28N4O/c1-18-7-4-9-21(13-18)15-22-14-20(3)28-23(16-22)25-10-6-12-31(25)27(32)24-17-30-11-5-8-19(2)26(30)29-24/h4-5,7-9,11,13-14,16-17,25H,6,10,12,15H2,1-3H3/t25-/m1/s1
• InChIKey: HCKJPXXSVQNTPZ-RUZDIDTESA-N
• XLogP: 5.22
• TPSA: 50.50 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 4
• Heavy Atoms: 32
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	424.55
LogP ≤ 5	5.22
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of (8-methylimidazo[1,2-a]pyridin-2-yl)-[(2R)-2-[6-methyl-4-[(3-methylphenyl)methyl]-2-pyridinyl]pyrrolidin-1-yl]methanone?

The IUPAC name of (8-methylimidazo[1,2-a]pyridin-2-yl)-[(2R)-2-[6-methyl-4-[(3-methylphenyl)methyl]-2-pyridinyl]pyrrolidin-1-yl]methanone (CID 92617149) is (8-methylimidazo[1,2-a]pyridin-2-yl)-[(2R)-2-[6-methyl-4-[(3-methylphenyl)methyl]-2-pyridinyl]pyrrolidin-1-yl]methanone.

What is the SMILES notation for (8-methylimidazo[1,2-a]pyridin-2-yl)-[(2R)-2-[6-methyl-4-[(3-methylphenyl)methyl]-2-pyridinyl]pyrrolidin-1-yl]methanone?

The canonical SMILES for (8-methylimidazo[1,2-a]pyridin-2-yl)-[(2R)-2-[6-methyl-4-[(3-methylphenyl)methyl]-2-pyridinyl]pyrrolidin-1-yl]methanone is Cc1cccc(Cc2cc(C)nc([C@H]3CCCN3C(=O)c3cn4cccc(C)c4n3)c2)c1.

What is the InChIKey of (8-methylimidazo[1,2-a]pyridin-2-yl)-[(2R)-2-[6-methyl-4-[(3-methylphenyl)methyl]-2-pyridinyl]pyrrolidin-1-yl]methanone?

The InChIKey is HCKJPXXSVQNTPZ-RUZDIDTESA-N. The full InChI is InChI=1S/C27H28N4O/c1-18-7-4-9-21(13-18)15-22-14-20(3)28-23(16-22)25-10-6-12-31(25)27(32)24-17-30-11-5-8-19(2)26(30)29-24/h4-5,7-9,11,13-14,16-17,25H,6,10,12,15H2,1-3H3/t25-/m1/s1.

What are the key properties of (8-methylimidazo[1,2-a]pyridin-2-yl)-[(2R)-2-[6-methyl-4-[(3-methylphenyl)methyl]-2-pyridinyl]pyrrolidin-1-yl]methanone?

(8-methylimidazo[1,2-a]pyridin-2-yl)-[(2R)-2-[6-methyl-4-[(3-methylphenyl)methyl]-2-pyridinyl]pyrrolidin-1-yl]methanone has a molecular weight of 424.55 g/mol, XLogP of 5.22, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for (8-methylimidazo[1,2-a]pyridin-2-yl)-[(2R)-2-[6-methyl-4-[(3-methylphenyl)methyl]-2-pyridinyl]pyrrolidin-1-yl]methanone is sourced from PubChem (CID 92617149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).