N-methyl-3-[(3R)-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-yl]-N-(2-pyridin-2-ylethyl)propanamide

C23H32N4O — CID 25289755

About N-methyl-3-[(3R)-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-yl]-N-(2-pyridin-2-ylethyl)propanamide

N-methyl-3-[(3R)-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-yl]-N-(2-pyridin-2-ylethyl)propanamide (PubChem CID 25289755) has the molecular formula C23H32N4O and a molecular weight of 380.54 g/mol. Its IUPAC name is N-methyl-3-[(3R)-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-yl]-N-(2-pyridin-2-ylethyl)propanamide.

Molecular Properties

• Compound Name: N-methyl-3-[(3R)-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-yl]-N-(2-pyridin-2-ylethyl)propanamide
• PubChem CID: 25289755
• Molecular Formula: C23H32N4O
• Molecular Weight: 380.54 g/mol
• Exact Mass: 380.26
• IUPAC Name: N-methyl-3-[(3R)-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-yl]-N-(2-pyridin-2-ylethyl)propanamide
• SMILES: Cc1cccc(CN2CCC[C@H](CCC(=O)N(C)CCc3ccccn3)C2)n1
• InChI: InChI=1S/C23H32N4O/c1-19-7-5-10-22(25-19)18-27-15-6-8-20(17-27)11-12-23(28)26(2)16-13-21-9-3-4-14-24-21/h3-5,7,9-10,14,20H,6,8,11-13,15-18H2,1-2H3/t20-/m1/s1
• InChIKey: KTNZKWTYXOFPFJ-HXUWFJFHSA-N
• XLogP: 3.48
• TPSA: 49.33 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 8
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	380.54
LogP ≤ 5	3.48
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-[(3R)-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-yl]-N-(2-pyridin-2-ylethyl)propanamide?

The IUPAC name of N-methyl-3-[(3R)-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-yl]-N-(2-pyridin-2-ylethyl)propanamide (CID 25289755) is N-methyl-3-[(3R)-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-yl]-N-(2-pyridin-2-ylethyl)propanamide.

What is the SMILES notation for N-methyl-3-[(3R)-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-yl]-N-(2-pyridin-2-ylethyl)propanamide?

The canonical SMILES for N-methyl-3-[(3R)-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-yl]-N-(2-pyridin-2-ylethyl)propanamide is Cc1cccc(CN2CCC[C@H](CCC(=O)N(C)CCc3ccccn3)C2)n1.

What is the InChIKey of N-methyl-3-[(3R)-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-yl]-N-(2-pyridin-2-ylethyl)propanamide?

The InChIKey is KTNZKWTYXOFPFJ-HXUWFJFHSA-N. The full InChI is InChI=1S/C23H32N4O/c1-19-7-5-10-22(25-19)18-27-15-6-8-20(17-27)11-12-23(28)26(2)16-13-21-9-3-4-14-24-21/h3-5,7,9-10,14,20H,6,8,11-13,15-18H2,1-2H3/t20-/m1/s1.

What are the key properties of N-methyl-3-[(3R)-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-yl]-N-(2-pyridin-2-ylethyl)propanamide?

N-methyl-3-[(3R)-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-yl]-N-(2-pyridin-2-ylethyl)propanamide has a molecular weight of 380.54 g/mol, XLogP of 3.48, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for N-methyl-3-[(3R)-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-yl]-N-(2-pyridin-2-ylethyl)propanamide is sourced from PubChem (CID 25289755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).