1-[2-[3-[5-[(6-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetyl]piperidine-4-carboxamide

C24H32N6O2 — CID 110252308

About 1-[2-[3-[5-[(6-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetyl]piperidine-4-carboxamide

1-[2-[3-[5-[(6-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetyl]piperidine-4-carboxamide (PubChem CID 110252308) has the molecular formula C24H32N6O2 and a molecular weight of 436.56 g/mol. Its IUPAC name is 1-[2-[3-[5-[(6-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetyl]piperidine-4-carboxamide.

Molecular Properties

• Compound Name: 1-[2-[3-[5-[(6-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetyl]piperidine-4-carboxamide
• PubChem CID: 110252308
• Molecular Formula: C24H32N6O2
• Molecular Weight: 436.56 g/mol
• Exact Mass: 436.26
• IUPAC Name: 1-[2-[3-[5-[(6-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetyl]piperidine-4-carboxamide
• SMILES: Cc1cccc(Nc2ccc(C3CCCN(CC(=O)N4CCC(C(N)=O)CC4)C3)nc2)n1
• InChI: InChI=1S/C24H32N6O2/c1-17-4-2-6-22(27-17)28-20-7-8-21(26-14-20)19-5-3-11-29(15-19)16-23(31)30-12-9-18(10-13-30)24(25)32/h2,4,6-8,14,18-19H,3,5,9-13,15-16H2,1H3,(H2,25,32)(H,27,28)
• InChIKey: SPMBGQFNZCMHOA-UHFFFAOYSA-N
• XLogP: 2.43
• TPSA: 104.45 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 6
• Rotatable Bonds: 6
• Heavy Atoms: 32
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	436.56
LogP ≤ 5	2.43
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 1-[2-[3-[5-[(6-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetyl]piperidine-4-carboxamide?

The IUPAC name of 1-[2-[3-[5-[(6-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetyl]piperidine-4-carboxamide (CID 110252308) is 1-[2-[3-[5-[(6-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetyl]piperidine-4-carboxamide.

What is the SMILES notation for 1-[2-[3-[5-[(6-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetyl]piperidine-4-carboxamide?

The canonical SMILES for 1-[2-[3-[5-[(6-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetyl]piperidine-4-carboxamide is Cc1cccc(Nc2ccc(C3CCCN(CC(=O)N4CCC(C(N)=O)CC4)C3)nc2)n1.

What is the InChIKey of 1-[2-[3-[5-[(6-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetyl]piperidine-4-carboxamide?

The InChIKey is SPMBGQFNZCMHOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H32N6O2/c1-17-4-2-6-22(27-17)28-20-7-8-21(26-14-20)19-5-3-11-29(15-19)16-23(31)30-12-9-18(10-13-30)24(25)32/h2,4,6-8,14,18-19H,3,5,9-13,15-16H2,1H3,(H2,25,32)(H,27,28).

What are the key properties of 1-[2-[3-[5-[(6-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetyl]piperidine-4-carboxamide?

1-[2-[3-[5-[(6-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetyl]piperidine-4-carboxamide has a molecular weight of 436.56 g/mol, XLogP of 2.43, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[2-[3-[5-[(6-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetyl]piperidine-4-carboxamide is sourced from PubChem (CID 110252308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).