3-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-1-(2,3-dihydro-1H-inden-4-yl)-4-methylpyridin-2-one

C22H22N4O2 — CID 172659336

About 3-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-1-(2,3-dihydro-1H-inden-4-yl)-4-methylpyridin-2-one

3-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-1-(2,3-dihydro-1H-inden-4-yl)-4-methylpyridin-2-one (PubChem CID 172659336) has the molecular formula C22H22N4O2 and a molecular weight of 374.44 g/mol. Its IUPAC name is 3-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-1-(2,3-dihydro-1H-inden-4-yl)-4-methylpyridin-2-one.

Molecular Properties

• Compound Name: 3-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-1-(2,3-dihydro-1H-inden-4-yl)-4-methylpyridin-2-one
• PubChem CID: 172659336
• Molecular Formula: C22H22N4O2
• Molecular Weight: 374.44 g/mol
• Exact Mass: 374.17
• IUPAC Name: 3-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-1-(2,3-dihydro-1H-inden-4-yl)-4-methylpyridin-2-one
• SMILES: Cc1ccn(-c2cccc3c2CCC3)c(=O)c1C(=O)N1CCn2cncc2C1
• InChI: InChI=1S/C22H22N4O2/c1-15-8-9-26(19-7-3-5-16-4-2-6-18(16)19)22(28)20(15)21(27)24-10-11-25-14-23-12-17(25)13-24/h3,5,7-9,12,14H,2,4,6,10-11,13H2,1H3
• InChIKey: QBTKXWYADQGQHR-UHFFFAOYSA-N
• XLogP: 2.49
• TPSA: 60.13 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 2
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	374.44
LogP ≤ 5	2.49
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 3-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-1-(2,3-dihydro-1H-inden-4-yl)-4-methylpyridin-2-one?

The IUPAC name of 3-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-1-(2,3-dihydro-1H-inden-4-yl)-4-methylpyridin-2-one (CID 172659336) is 3-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-1-(2,3-dihydro-1H-inden-4-yl)-4-methylpyridin-2-one.

What is the SMILES notation for 3-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-1-(2,3-dihydro-1H-inden-4-yl)-4-methylpyridin-2-one?

The canonical SMILES for 3-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-1-(2,3-dihydro-1H-inden-4-yl)-4-methylpyridin-2-one is Cc1ccn(-c2cccc3c2CCC3)c(=O)c1C(=O)N1CCn2cncc2C1.

What is the InChIKey of 3-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-1-(2,3-dihydro-1H-inden-4-yl)-4-methylpyridin-2-one?

The InChIKey is QBTKXWYADQGQHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N4O2/c1-15-8-9-26(19-7-3-5-16-4-2-6-18(16)19)22(28)20(15)21(27)24-10-11-25-14-23-12-17(25)13-24/h3,5,7-9,12,14H,2,4,6,10-11,13H2,1H3.

What are the key properties of 3-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-1-(2,3-dihydro-1H-inden-4-yl)-4-methylpyridin-2-one?

3-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-1-(2,3-dihydro-1H-inden-4-yl)-4-methylpyridin-2-one has a molecular weight of 374.44 g/mol, XLogP of 2.49, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 3-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-1-(2,3-dihydro-1H-inden-4-yl)-4-methylpyridin-2-one is sourced from PubChem (CID 172659336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).