5-[(2-methoxyethylamino)methyl]-N-(6-methoxy-3-pyridinyl)-3-(4-methyl-1,3,5-triazin-2-yl)pyridin-2-amine

C19H23N7O2 — CID 68792912

About 5-[(2-methoxyethylamino)methyl]-N-(6-methoxy-3-pyridinyl)-3-(4-methyl-1,3,5-triazin-2-yl)pyridin-2-amine

5-[(2-methoxyethylamino)methyl]-N-(6-methoxy-3-pyridinyl)-3-(4-methyl-1,3,5-triazin-2-yl)pyridin-2-amine (PubChem CID 68792912) has the molecular formula C19H23N7O2 and a molecular weight of 381.44 g/mol. Its IUPAC name is 5-[(2-methoxyethylamino)methyl]-N-(6-methoxy-3-pyridinyl)-3-(4-methyl-1,3,5-triazin-2-yl)pyridin-2-amine.

Molecular Properties

• Compound Name: 5-[(2-methoxyethylamino)methyl]-N-(6-methoxy-3-pyridinyl)-3-(4-methyl-1,3,5-triazin-2-yl)pyridin-2-amine
• PubChem CID: 68792912
• Molecular Formula: C19H23N7O2
• Molecular Weight: 381.44 g/mol
• Exact Mass: 381.19
• IUPAC Name: 5-[(2-methoxyethylamino)methyl]-N-(6-methoxy-3-pyridinyl)-3-(4-methyl-1,3,5-triazin-2-yl)pyridin-2-amine
• SMILES: COCCNCc1cnc(Nc2ccc(OC)nc2)c(-c2ncnc(C)n2)c1
• InChI: InChI=1S/C19H23N7O2/c1-13-23-12-24-19(25-13)16-8-14(9-20-6-7-27-2)10-22-18(16)26-15-4-5-17(28-3)21-11-15/h4-5,8,10-12,20H,6-7,9H2,1-3H3,(H,22,26)
• InChIKey: WETILAUQSSSTCI-UHFFFAOYSA-N
• XLogP: 2.13
• TPSA: 106.97 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 9
• Rotatable Bonds: 9
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	381.44
LogP ≤ 5	2.13
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	9

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-[(2-methoxyethylamino)methyl]-N-(6-methoxy-3-pyridinyl)-3-(4-methyl-1,3,5-triazin-2-yl)pyridin-2-amine?

The IUPAC name of 5-[(2-methoxyethylamino)methyl]-N-(6-methoxy-3-pyridinyl)-3-(4-methyl-1,3,5-triazin-2-yl)pyridin-2-amine (CID 68792912) is 5-[(2-methoxyethylamino)methyl]-N-(6-methoxy-3-pyridinyl)-3-(4-methyl-1,3,5-triazin-2-yl)pyridin-2-amine.

What is the SMILES notation for 5-[(2-methoxyethylamino)methyl]-N-(6-methoxy-3-pyridinyl)-3-(4-methyl-1,3,5-triazin-2-yl)pyridin-2-amine?

The canonical SMILES for 5-[(2-methoxyethylamino)methyl]-N-(6-methoxy-3-pyridinyl)-3-(4-methyl-1,3,5-triazin-2-yl)pyridin-2-amine is COCCNCc1cnc(Nc2ccc(OC)nc2)c(-c2ncnc(C)n2)c1.

What is the InChIKey of 5-[(2-methoxyethylamino)methyl]-N-(6-methoxy-3-pyridinyl)-3-(4-methyl-1,3,5-triazin-2-yl)pyridin-2-amine?

The InChIKey is WETILAUQSSSTCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N7O2/c1-13-23-12-24-19(25-13)16-8-14(9-20-6-7-27-2)10-22-18(16)26-15-4-5-17(28-3)21-11-15/h4-5,8,10-12,20H,6-7,9H2,1-3H3,(H,22,26).

What are the key properties of 5-[(2-methoxyethylamino)methyl]-N-(6-methoxy-3-pyridinyl)-3-(4-methyl-1,3,5-triazin-2-yl)pyridin-2-amine?

5-[(2-methoxyethylamino)methyl]-N-(6-methoxy-3-pyridinyl)-3-(4-methyl-1,3,5-triazin-2-yl)pyridin-2-amine has a molecular weight of 381.44 g/mol, XLogP of 2.13, 9 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[(2-methoxyethylamino)methyl]-N-(6-methoxy-3-pyridinyl)-3-(4-methyl-1,3,5-triazin-2-yl)pyridin-2-amine is sourced from PubChem (CID 68792912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).