N-[2-(1H-indol-3-yl)-2-phenylethyl]-2-[3-(methylamino)piperidin-1-yl]acetamide;hydrochloride

C24H31ClN4O — CID 119918683

About N-[2-(1H-indol-3-yl)-2-phenylethyl]-2-[3-(methylamino)piperidin-1-yl]acetamide;hydrochloride

N-[2-(1H-indol-3-yl)-2-phenylethyl]-2-[3-(methylamino)piperidin-1-yl]acetamide;hydrochloride (PubChem CID 119918683) has the molecular formula C24H31ClN4O and a molecular weight of 426.99 g/mol. Its IUPAC name is N-[2-(1H-indol-3-yl)-2-phenylethyl]-2-[3-(methylamino)piperidin-1-yl]acetamide;hydrochloride.

Molecular Properties

• Compound Name: N-[2-(1H-indol-3-yl)-2-phenylethyl]-2-[3-(methylamino)piperidin-1-yl]acetamide;hydrochloride
• PubChem CID: 119918683
• Molecular Formula: C24H31ClN4O
• Molecular Weight: 426.99 g/mol
• Exact Mass: 426.22
• IUPAC Name: N-[2-(1H-indol-3-yl)-2-phenylethyl]-2-[3-(methylamino)piperidin-1-yl]acetamide;hydrochloride
• SMILES: CNC1CCCN(CC(=O)NCC(c2ccccc2)c2c[nH]c3ccccc23)C1.Cl
• InChI: InChI=1S/C24H30N4O.ClH/c1-25-19-10-7-13-28(16-19)17-24(29)27-14-21(18-8-3-2-4-9-18)22-15-26-23-12-6-5-11-20(22)23;/h2-6,8-9,11-12,15,19,21,25-26H,7,10,13-14,16-17H2,1H3,(H,27,29);1H
• InChIKey: CFGKALYAZMIQDQ-UHFFFAOYSA-N
• XLogP: 3.52
• TPSA: 60.16 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 3
• Rotatable Bonds: 7
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	426.99
LogP ≤ 5	3.52
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of N-[2-(1H-indol-3-yl)-2-phenylethyl]-2-[3-(methylamino)piperidin-1-yl]acetamide;hydrochloride?

The IUPAC name of N-[2-(1H-indol-3-yl)-2-phenylethyl]-2-[3-(methylamino)piperidin-1-yl]acetamide;hydrochloride (CID 119918683) is N-[2-(1H-indol-3-yl)-2-phenylethyl]-2-[3-(methylamino)piperidin-1-yl]acetamide;hydrochloride.

What is the SMILES notation for N-[2-(1H-indol-3-yl)-2-phenylethyl]-2-[3-(methylamino)piperidin-1-yl]acetamide;hydrochloride?

The canonical SMILES for N-[2-(1H-indol-3-yl)-2-phenylethyl]-2-[3-(methylamino)piperidin-1-yl]acetamide;hydrochloride is CNC1CCCN(CC(=O)NCC(c2ccccc2)c2c[nH]c3ccccc23)C1.Cl.

What is the InChIKey of N-[2-(1H-indol-3-yl)-2-phenylethyl]-2-[3-(methylamino)piperidin-1-yl]acetamide;hydrochloride?

The InChIKey is CFGKALYAZMIQDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N4O.ClH/c1-25-19-10-7-13-28(16-19)17-24(29)27-14-21(18-8-3-2-4-9-18)22-15-26-23-12-6-5-11-20(22)23;/h2-6,8-9,11-12,15,19,21,25-26H,7,10,13-14,16-17H2,1H3,(H,27,29);1H.

What are the key properties of N-[2-(1H-indol-3-yl)-2-phenylethyl]-2-[3-(methylamino)piperidin-1-yl]acetamide;hydrochloride?

N-[2-(1H-indol-3-yl)-2-phenylethyl]-2-[3-(methylamino)piperidin-1-yl]acetamide;hydrochloride has a molecular weight of 426.99 g/mol, XLogP of 3.52, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-(1H-indol-3-yl)-2-phenylethyl]-2-[3-(methylamino)piperidin-1-yl]acetamide;hydrochloride is sourced from PubChem (CID 119918683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).