4-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-methylimidazole-1,5-diamine

C15H20N4O2 — CID 62482979

About 4-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-methylimidazole-1,5-diamine

4-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-methylimidazole-1,5-diamine (PubChem CID 62482979) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is 4-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-methylimidazole-1,5-diamine.

Molecular Properties

• Compound Name: 4-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-methylimidazole-1,5-diamine
• PubChem CID: 62482979
• Molecular Formula: C15H20N4O2
• Molecular Weight: 288.35 g/mol
• Exact Mass: 288.16
• IUPAC Name: 4-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-methylimidazole-1,5-diamine
• SMILES: CCOc1cc2c(cc1-c1nc(C)n(N)c1N)OC(C)C2
• InChI: InChI=1S/C15H20N4O2/c1-4-20-13-6-10-5-8(2)21-12(10)7-11(13)14-15(16)19(17)9(3)18-14/h6-8H,4-5,16-17H2,1-3H3
• InChIKey: NDGLJQMLNLUNJB-UHFFFAOYSA-N
• XLogP: 1.88
• TPSA: 88.32 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 6
• Rotatable Bonds: 3
• Heavy Atoms: 21
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	288.35
LogP ≤ 5	1.88
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 4-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-methylimidazole-1,5-diamine?

The IUPAC name of 4-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-methylimidazole-1,5-diamine (CID 62482979) is 4-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-methylimidazole-1,5-diamine.

What is the SMILES notation for 4-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-methylimidazole-1,5-diamine?

The canonical SMILES for 4-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-methylimidazole-1,5-diamine is CCOc1cc2c(cc1-c1nc(C)n(N)c1N)OC(C)C2.

What is the InChIKey of 4-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-methylimidazole-1,5-diamine?

The InChIKey is NDGLJQMLNLUNJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2/c1-4-20-13-6-10-5-8(2)21-12(10)7-11(13)14-15(16)19(17)9(3)18-14/h6-8H,4-5,16-17H2,1-3H3.

What are the key properties of 4-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-methylimidazole-1,5-diamine?

4-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-methylimidazole-1,5-diamine has a molecular weight of 288.35 g/mol, XLogP of 1.88, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 4-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-methylimidazole-1,5-diamine is sourced from PubChem (CID 62482979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).