2-(2-morpholin-4-ylethylamino)-N-(1-phenylethyl)pyridine-4-carboxamide

C₂₀H₂₆N₄O₂ — CID 109168033

About 2-(2-morpholin-4-ylethylamino)-N-(1-phenylethyl)pyridine-4-carboxamide

2-(2-morpholin-4-ylethylamino)-N-(1-phenylethyl)pyridine-4-carboxamide (PubChem CID 109168033) has the molecular formula C₂₀H₂₆N₄O₂ and a molecular weight of 354.45 g/mol. Its IUPAC name is 2-(2-morpholin-4-ylethylamino)-N-(1-phenylethyl)pyridine-4-carboxamide.

Molecular Properties

• Compound Name: 2-(2-morpholin-4-ylethylamino)-N-(1-phenylethyl)pyridine-4-carboxamide
• PubChem CID: 109168033
• Molecular Formula: C₂₀H₂₆N₄O₂
• Molecular Weight: 354.45 g/mol
• Exact Mass: 354.21
• IUPAC Name: 2-(2-morpholin-4-ylethylamino)-N-(1-phenylethyl)pyridine-4-carboxamide
• SMILES: CC(NC(=O)c1ccnc(NCCN2CCOCC2)c1)c1ccccc1
• InChI: InChI=1S/C20H26N4O2/c1-16(17-5-3-2-4-6-17)23-20(25)18-7-8-21-19(15-18)22-9-10-24-11-13-26-14-12-24/h2-8,15-16H,9-14H2,1H3,(H,21,22)(H,23,25)
• InChIKey: OQNJHSIIVRQRLM-UHFFFAOYSA-N
• XLogP: 2.32
• TPSA: 66.49 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 5
• Rotatable Bonds: 7
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	354.45
LogP ≤ 5	2.32
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 2-(2-morpholin-4-ylethylamino)-N-(1-phenylethyl)pyridine-4-carboxamide?

The IUPAC name of 2-(2-morpholin-4-ylethylamino)-N-(1-phenylethyl)pyridine-4-carboxamide (CID 109168033) is 2-(2-morpholin-4-ylethylamino)-N-(1-phenylethyl)pyridine-4-carboxamide.

What is the SMILES notation for 2-(2-morpholin-4-ylethylamino)-N-(1-phenylethyl)pyridine-4-carboxamide?

The canonical SMILES for 2-(2-morpholin-4-ylethylamino)-N-(1-phenylethyl)pyridine-4-carboxamide is CC(NC(=O)c1ccnc(NCCN2CCOCC2)c1)c1ccccc1.

What is the InChIKey of 2-(2-morpholin-4-ylethylamino)-N-(1-phenylethyl)pyridine-4-carboxamide?

The InChIKey is OQNJHSIIVRQRLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O2/c1-16(17-5-3-2-4-6-17)23-20(25)18-7-8-21-19(15-18)22-9-10-24-11-13-26-14-12-24/h2-8,15-16H,9-14H2,1H3,(H,21,22)(H,23,25).

What are the key properties of 2-(2-morpholin-4-ylethylamino)-N-(1-phenylethyl)pyridine-4-carboxamide?

2-(2-morpholin-4-ylethylamino)-N-(1-phenylethyl)pyridine-4-carboxamide has a molecular weight of 354.45 g/mol, XLogP of 2.32, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(2-morpholin-4-ylethylamino)-N-(1-phenylethyl)pyridine-4-carboxamide is sourced from PubChem (CID 109168033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 109168033 — identifiers, structure, computed properties (public domain)

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