(2-ethylpyrazol-3-yl)-[3-[3-(2-methylpropyl)imidazo[4,5-c]pyridin-2-yl]pyrrolidin-1-yl]methanone

C20H26N6O — CID 83272689

About (2-ethylpyrazol-3-yl)-[3-[3-(2-methylpropyl)imidazo[4,5-c]pyridin-2-yl]pyrrolidin-1-yl]methanone

(2-ethylpyrazol-3-yl)-[3-[3-(2-methylpropyl)imidazo[4,5-c]pyridin-2-yl]pyrrolidin-1-yl]methanone (PubChem CID 83272689) has the molecular formula C20H26N6O and a molecular weight of 366.47 g/mol. Its IUPAC name is (2-ethylpyrazol-3-yl)-[3-[3-(2-methylpropyl)imidazo[4,5-c]pyridin-2-yl]pyrrolidin-1-yl]methanone.

Molecular Properties

• Compound Name: (2-ethylpyrazol-3-yl)-[3-[3-(2-methylpropyl)imidazo[4,5-c]pyridin-2-yl]pyrrolidin-1-yl]methanone
• PubChem CID: 83272689
• Molecular Formula: C20H26N6O
• Molecular Weight: 366.47 g/mol
• Exact Mass: 366.22
• IUPAC Name: (2-ethylpyrazol-3-yl)-[3-[3-(2-methylpropyl)imidazo[4,5-c]pyridin-2-yl]pyrrolidin-1-yl]methanone
• SMILES: CCn1nccc1C(=O)N1CCC(c2nc3ccncc3n2CC(C)C)C1
• InChI: InChI=1S/C20H26N6O/c1-4-26-17(6-9-22-26)20(27)24-10-7-15(13-24)19-23-16-5-8-21-11-18(16)25(19)12-14(2)3/h5-6,8-9,11,14-15H,4,7,10,12-13H2,1-3H3
• InChIKey: LLSOCDZDLZETFU-UHFFFAOYSA-N
• XLogP: 2.93
• TPSA: 68.84 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 5
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	366.47
LogP ≤ 5	2.93
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of (2-ethylpyrazol-3-yl)-[3-[3-(2-methylpropyl)imidazo[4,5-c]pyridin-2-yl]pyrrolidin-1-yl]methanone?

The IUPAC name of (2-ethylpyrazol-3-yl)-[3-[3-(2-methylpropyl)imidazo[4,5-c]pyridin-2-yl]pyrrolidin-1-yl]methanone (CID 83272689) is (2-ethylpyrazol-3-yl)-[3-[3-(2-methylpropyl)imidazo[4,5-c]pyridin-2-yl]pyrrolidin-1-yl]methanone.

What is the SMILES notation for (2-ethylpyrazol-3-yl)-[3-[3-(2-methylpropyl)imidazo[4,5-c]pyridin-2-yl]pyrrolidin-1-yl]methanone?

The canonical SMILES for (2-ethylpyrazol-3-yl)-[3-[3-(2-methylpropyl)imidazo[4,5-c]pyridin-2-yl]pyrrolidin-1-yl]methanone is CCn1nccc1C(=O)N1CCC(c2nc3ccncc3n2CC(C)C)C1.

What is the InChIKey of (2-ethylpyrazol-3-yl)-[3-[3-(2-methylpropyl)imidazo[4,5-c]pyridin-2-yl]pyrrolidin-1-yl]methanone?

The InChIKey is LLSOCDZDLZETFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N6O/c1-4-26-17(6-9-22-26)20(27)24-10-7-15(13-24)19-23-16-5-8-21-11-18(16)25(19)12-14(2)3/h5-6,8-9,11,14-15H,4,7,10,12-13H2,1-3H3.

What are the key properties of (2-ethylpyrazol-3-yl)-[3-[3-(2-methylpropyl)imidazo[4,5-c]pyridin-2-yl]pyrrolidin-1-yl]methanone?

(2-ethylpyrazol-3-yl)-[3-[3-(2-methylpropyl)imidazo[4,5-c]pyridin-2-yl]pyrrolidin-1-yl]methanone has a molecular weight of 366.47 g/mol, XLogP of 2.93, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for (2-ethylpyrazol-3-yl)-[3-[3-(2-methylpropyl)imidazo[4,5-c]pyridin-2-yl]pyrrolidin-1-yl]methanone is sourced from PubChem (CID 83272689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).