2-(6-methyl-5-propan-2-yl-1-benzofuran-3-yl)-N-[[(2R)-5-oxopyrrolidin-2-yl]methyl]acetamide

C19H24N2O3 — CID 95321206

About 2-(6-methyl-5-propan-2-yl-1-benzofuran-3-yl)-N-[[(2R)-5-oxopyrrolidin-2-yl]methyl]acetamide

2-(6-methyl-5-propan-2-yl-1-benzofuran-3-yl)-N-[[(2R)-5-oxopyrrolidin-2-yl]methyl]acetamide (PubChem CID 95321206) has the molecular formula C19H24N2O3 and a molecular weight of 328.41 g/mol. Its IUPAC name is 2-(6-methyl-5-propan-2-yl-1-benzofuran-3-yl)-N-[[(2R)-5-oxopyrrolidin-2-yl]methyl]acetamide.

Molecular Properties

• Compound Name: 2-(6-methyl-5-propan-2-yl-1-benzofuran-3-yl)-N-[[(2R)-5-oxopyrrolidin-2-yl]methyl]acetamide
• PubChem CID: 95321206
• Molecular Formula: C19H24N2O3
• Molecular Weight: 328.41 g/mol
• Exact Mass: 328.18
• IUPAC Name: 2-(6-methyl-5-propan-2-yl-1-benzofuran-3-yl)-N-[[(2R)-5-oxopyrrolidin-2-yl]methyl]acetamide
• SMILES: Cc1cc2occ(CC(=O)NC[C@H]3CCC(=O)N3)c2cc1C(C)C
• InChI: InChI=1S/C19H24N2O3/c1-11(2)15-8-16-13(10-24-17(16)6-12(15)3)7-19(23)20-9-14-4-5-18(22)21-14/h6,8,10-11,14H,4-5,7,9H2,1-3H3,(H,20,23)(H,21,22)/t14-/m1/s1
• InChIKey: DIUMLPRPRNQKME-CQSZACIVSA-N
• XLogP: 2.80
• TPSA: 71.34 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 3
• Rotatable Bonds: 5
• Heavy Atoms: 24
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	328.41
LogP ≤ 5	2.80
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of 2-(6-methyl-5-propan-2-yl-1-benzofuran-3-yl)-N-[[(2R)-5-oxopyrrolidin-2-yl]methyl]acetamide?

The IUPAC name of 2-(6-methyl-5-propan-2-yl-1-benzofuran-3-yl)-N-[[(2R)-5-oxopyrrolidin-2-yl]methyl]acetamide (CID 95321206) is 2-(6-methyl-5-propan-2-yl-1-benzofuran-3-yl)-N-[[(2R)-5-oxopyrrolidin-2-yl]methyl]acetamide.

What is the SMILES notation for 2-(6-methyl-5-propan-2-yl-1-benzofuran-3-yl)-N-[[(2R)-5-oxopyrrolidin-2-yl]methyl]acetamide?

The canonical SMILES for 2-(6-methyl-5-propan-2-yl-1-benzofuran-3-yl)-N-[[(2R)-5-oxopyrrolidin-2-yl]methyl]acetamide is Cc1cc2occ(CC(=O)NC[C@H]3CCC(=O)N3)c2cc1C(C)C.

What is the InChIKey of 2-(6-methyl-5-propan-2-yl-1-benzofuran-3-yl)-N-[[(2R)-5-oxopyrrolidin-2-yl]methyl]acetamide?

The InChIKey is DIUMLPRPRNQKME-CQSZACIVSA-N. The full InChI is InChI=1S/C19H24N2O3/c1-11(2)15-8-16-13(10-24-17(16)6-12(15)3)7-19(23)20-9-14-4-5-18(22)21-14/h6,8,10-11,14H,4-5,7,9H2,1-3H3,(H,20,23)(H,21,22)/t14-/m1/s1.

What are the key properties of 2-(6-methyl-5-propan-2-yl-1-benzofuran-3-yl)-N-[[(2R)-5-oxopyrrolidin-2-yl]methyl]acetamide?

2-(6-methyl-5-propan-2-yl-1-benzofuran-3-yl)-N-[[(2R)-5-oxopyrrolidin-2-yl]methyl]acetamide has a molecular weight of 328.41 g/mol, XLogP of 2.80, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(6-methyl-5-propan-2-yl-1-benzofuran-3-yl)-N-[[(2R)-5-oxopyrrolidin-2-yl]methyl]acetamide is sourced from PubChem (CID 95321206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).