3-methyl-8-[6-(1-methylpyrazol-4-yl)-3-pyridinyl]-1H-imidazo[4,5-c]quinolin-2-one;piperidine

C25H27N7O — CID 144847102

About 3-methyl-8-[6-(1-methylpyrazol-4-yl)-3-pyridinyl]-1H-imidazo[4,5-c]quinolin-2-one;piperidine

3-methyl-8-[6-(1-methylpyrazol-4-yl)-3-pyridinyl]-1H-imidazo[4,5-c]quinolin-2-one;piperidine (PubChem CID 144847102) has the molecular formula C25H27N7O and a molecular weight of 441.54 g/mol. Its IUPAC name is 3-methyl-8-[6-(1-methylpyrazol-4-yl)-3-pyridinyl]-1H-imidazo[4,5-c]quinolin-2-one;piperidine.

Molecular Properties

• Compound Name: 3-methyl-8-[6-(1-methylpyrazol-4-yl)-3-pyridinyl]-1H-imidazo[4,5-c]quinolin-2-one;piperidine
• PubChem CID: 144847102
• Molecular Formula: C25H27N7O
• Molecular Weight: 441.54 g/mol
• Exact Mass: 441.23
• IUPAC Name: 3-methyl-8-[6-(1-methylpyrazol-4-yl)-3-pyridinyl]-1H-imidazo[4,5-c]quinolin-2-one;piperidine
• SMILES: C1CCNCC1.Cn1cc(-c2ccc(-c3ccc4ncc5c([nH]c(=O)n5C)c4c3)cn2)cn1
• InChI: InChI=1S/C20H16N6O.C5H11N/c1-25-11-14(9-23-25)16-5-4-13(8-21-16)12-3-6-17-15(7-12)19-18(10-22-17)26(2)20(27)24-19;1-2-4-6-5-3-1/h3-11H,1-2H3,(H,24,27);6H,1-5H2
• InChIKey: GXASGDFATGVNPP-UHFFFAOYSA-N
• XLogP: 3.64
• TPSA: 93.42 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 7
• Rotatable Bonds: 2
• Heavy Atoms: 33
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	441.54
LogP ≤ 5	3.64
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 3-methyl-8-[6-(1-methylpyrazol-4-yl)-3-pyridinyl]-1H-imidazo[4,5-c]quinolin-2-one;piperidine?

The IUPAC name of 3-methyl-8-[6-(1-methylpyrazol-4-yl)-3-pyridinyl]-1H-imidazo[4,5-c]quinolin-2-one;piperidine (CID 144847102) is 3-methyl-8-[6-(1-methylpyrazol-4-yl)-3-pyridinyl]-1H-imidazo[4,5-c]quinolin-2-one;piperidine.

What is the SMILES notation for 3-methyl-8-[6-(1-methylpyrazol-4-yl)-3-pyridinyl]-1H-imidazo[4,5-c]quinolin-2-one;piperidine?

The canonical SMILES for 3-methyl-8-[6-(1-methylpyrazol-4-yl)-3-pyridinyl]-1H-imidazo[4,5-c]quinolin-2-one;piperidine is C1CCNCC1.Cn1cc(-c2ccc(-c3ccc4ncc5c([nH]c(=O)n5C)c4c3)cn2)cn1.

What is the InChIKey of 3-methyl-8-[6-(1-methylpyrazol-4-yl)-3-pyridinyl]-1H-imidazo[4,5-c]quinolin-2-one;piperidine?

The InChIKey is GXASGDFATGVNPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N6O.C5H11N/c1-25-11-14(9-23-25)16-5-4-13(8-21-16)12-3-6-17-15(7-12)19-18(10-22-17)26(2)20(27)24-19;1-2-4-6-5-3-1/h3-11H,1-2H3,(H,24,27);6H,1-5H2.

What are the key properties of 3-methyl-8-[6-(1-methylpyrazol-4-yl)-3-pyridinyl]-1H-imidazo[4,5-c]quinolin-2-one;piperidine?

3-methyl-8-[6-(1-methylpyrazol-4-yl)-3-pyridinyl]-1H-imidazo[4,5-c]quinolin-2-one;piperidine has a molecular weight of 441.54 g/mol, XLogP of 3.64, 2 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 3-methyl-8-[6-(1-methylpyrazol-4-yl)-3-pyridinyl]-1H-imidazo[4,5-c]quinolin-2-one;piperidine is sourced from PubChem (CID 144847102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).