1-[4-[3-(piperidine-1-carbonyl)pyrazolo[1,5-a]pyridin-5-yl]piperidin-1-yl]pentan-1-one

C23H32N4O2 — CID 50849103

About 1-[4-[3-(piperidine-1-carbonyl)pyrazolo[1,5-a]pyridin-5-yl]piperidin-1-yl]pentan-1-one

1-[4-[3-(piperidine-1-carbonyl)pyrazolo[1,5-a]pyridin-5-yl]piperidin-1-yl]pentan-1-one (PubChem CID 50849103) has the molecular formula C23H32N4O2 and a molecular weight of 396.54 g/mol. Its IUPAC name is 1-[4-[3-(piperidine-1-carbonyl)pyrazolo[1,5-a]pyridin-5-yl]piperidin-1-yl]pentan-1-one.

Molecular Properties

• Compound Name: 1-[4-[3-(piperidine-1-carbonyl)pyrazolo[1,5-a]pyridin-5-yl]piperidin-1-yl]pentan-1-one
• PubChem CID: 50849103
• Molecular Formula: C23H32N4O2
• Molecular Weight: 396.54 g/mol
• Exact Mass: 396.25
• IUPAC Name: 1-[4-[3-(piperidine-1-carbonyl)pyrazolo[1,5-a]pyridin-5-yl]piperidin-1-yl]pentan-1-one
• SMILES: CCCCC(=O)N1CCC(c2ccn3ncc(C(=O)N4CCCCC4)c3c2)CC1
• InChI: InChI=1S/C23H32N4O2/c1-2-3-7-22(28)25-13-8-18(9-14-25)19-10-15-27-21(16-19)20(17-24-27)23(29)26-11-5-4-6-12-26/h10,15-18H,2-9,11-14H2,1H3
• InChIKey: KBVQFBGXCBEXFF-UHFFFAOYSA-N
• XLogP: 3.86
• TPSA: 57.92 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 5
• Heavy Atoms: 29
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	396.54
LogP ≤ 5	3.86
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 1-[4-[3-(piperidine-1-carbonyl)pyrazolo[1,5-a]pyridin-5-yl]piperidin-1-yl]pentan-1-one?

The IUPAC name of 1-[4-[3-(piperidine-1-carbonyl)pyrazolo[1,5-a]pyridin-5-yl]piperidin-1-yl]pentan-1-one (CID 50849103) is 1-[4-[3-(piperidine-1-carbonyl)pyrazolo[1,5-a]pyridin-5-yl]piperidin-1-yl]pentan-1-one.

What is the SMILES notation for 1-[4-[3-(piperidine-1-carbonyl)pyrazolo[1,5-a]pyridin-5-yl]piperidin-1-yl]pentan-1-one?

The canonical SMILES for 1-[4-[3-(piperidine-1-carbonyl)pyrazolo[1,5-a]pyridin-5-yl]piperidin-1-yl]pentan-1-one is CCCCC(=O)N1CCC(c2ccn3ncc(C(=O)N4CCCCC4)c3c2)CC1.

What is the InChIKey of 1-[4-[3-(piperidine-1-carbonyl)pyrazolo[1,5-a]pyridin-5-yl]piperidin-1-yl]pentan-1-one?

The InChIKey is KBVQFBGXCBEXFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H32N4O2/c1-2-3-7-22(28)25-13-8-18(9-14-25)19-10-15-27-21(16-19)20(17-24-27)23(29)26-11-5-4-6-12-26/h10,15-18H,2-9,11-14H2,1H3.

What are the key properties of 1-[4-[3-(piperidine-1-carbonyl)pyrazolo[1,5-a]pyridin-5-yl]piperidin-1-yl]pentan-1-one?

1-[4-[3-(piperidine-1-carbonyl)pyrazolo[1,5-a]pyridin-5-yl]piperidin-1-yl]pentan-1-one has a molecular weight of 396.54 g/mol, XLogP of 3.86, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[4-[3-(piperidine-1-carbonyl)pyrazolo[1,5-a]pyridin-5-yl]piperidin-1-yl]pentan-1-one is sourced from PubChem (CID 50849103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).