cyclopentyl-[3-[4-(3H-imidazo[4,5-c]pyridin-2-yl)piperidine-1-carbonyl]piperidin-1-yl]methanone

C23H31N5O2 — CID 134797363

About cyclopentyl-[3-[4-(3H-imidazo[4,5-c]pyridin-2-yl)piperidine-1-carbonyl]piperidin-1-yl]methanone

cyclopentyl-[3-[4-(3H-imidazo[4,5-c]pyridin-2-yl)piperidine-1-carbonyl]piperidin-1-yl]methanone (PubChem CID 134797363) has the molecular formula C23H31N5O2 and a molecular weight of 409.53 g/mol. Its IUPAC name is cyclopentyl-[3-[4-(3H-imidazo[4,5-c]pyridin-2-yl)piperidine-1-carbonyl]piperidin-1-yl]methanone.

Molecular Properties

• Compound Name: cyclopentyl-[3-[4-(3H-imidazo[4,5-c]pyridin-2-yl)piperidine-1-carbonyl]piperidin-1-yl]methanone
• PubChem CID: 134797363
• Molecular Formula: C23H31N5O2
• Molecular Weight: 409.53 g/mol
• Exact Mass: 409.25
• IUPAC Name: cyclopentyl-[3-[4-(3H-imidazo[4,5-c]pyridin-2-yl)piperidine-1-carbonyl]piperidin-1-yl]methanone
• SMILES: O=C(C1CCCN(C(=O)C2CCCC2)C1)N1CCC(c2nc3ccncc3[nH]2)CC1
• InChI: InChI=1S/C23H31N5O2/c29-22(17-4-1-2-5-17)28-11-3-6-18(15-28)23(30)27-12-8-16(9-13-27)21-25-19-7-10-24-14-20(19)26-21/h7,10,14,16-18H,1-6,8-9,11-13,15H2,(H,25,26)
• InChIKey: QNLLZSNCGCPVFK-UHFFFAOYSA-N
• XLogP: 3.09
• TPSA: 82.19 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 3
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	409.53
LogP ≤ 5	3.09
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of cyclopentyl-[3-[4-(3H-imidazo[4,5-c]pyridin-2-yl)piperidine-1-carbonyl]piperidin-1-yl]methanone?

The IUPAC name of cyclopentyl-[3-[4-(3H-imidazo[4,5-c]pyridin-2-yl)piperidine-1-carbonyl]piperidin-1-yl]methanone (CID 134797363) is cyclopentyl-[3-[4-(3H-imidazo[4,5-c]pyridin-2-yl)piperidine-1-carbonyl]piperidin-1-yl]methanone.

What is the SMILES notation for cyclopentyl-[3-[4-(3H-imidazo[4,5-c]pyridin-2-yl)piperidine-1-carbonyl]piperidin-1-yl]methanone?

The canonical SMILES for cyclopentyl-[3-[4-(3H-imidazo[4,5-c]pyridin-2-yl)piperidine-1-carbonyl]piperidin-1-yl]methanone is O=C(C1CCCN(C(=O)C2CCCC2)C1)N1CCC(c2nc3ccncc3[nH]2)CC1.

What is the InChIKey of cyclopentyl-[3-[4-(3H-imidazo[4,5-c]pyridin-2-yl)piperidine-1-carbonyl]piperidin-1-yl]methanone?

The InChIKey is QNLLZSNCGCPVFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H31N5O2/c29-22(17-4-1-2-5-17)28-11-3-6-18(15-28)23(30)27-12-8-16(9-13-27)21-25-19-7-10-24-14-20(19)26-21/h7,10,14,16-18H,1-6,8-9,11-13,15H2,(H,25,26).

What are the key properties of cyclopentyl-[3-[4-(3H-imidazo[4,5-c]pyridin-2-yl)piperidine-1-carbonyl]piperidin-1-yl]methanone?

cyclopentyl-[3-[4-(3H-imidazo[4,5-c]pyridin-2-yl)piperidine-1-carbonyl]piperidin-1-yl]methanone has a molecular weight of 409.53 g/mol, XLogP of 3.09, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for cyclopentyl-[3-[4-(3H-imidazo[4,5-c]pyridin-2-yl)piperidine-1-carbonyl]piperidin-1-yl]methanone is sourced from PubChem (CID 134797363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).