N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide

C26H34N4O5 — CID 46447043

About N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide

N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide (PubChem CID 46447043) has the molecular formula C26H34N4O5 and a molecular weight of 482.58 g/mol. Its IUPAC name is N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide.

Molecular Properties

• Compound Name: N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
• PubChem CID: 46447043
• Molecular Formula: C26H34N4O5
• Molecular Weight: 482.58 g/mol
• Exact Mass: 482.25
• IUPAC Name: N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
• SMILES: CCN(CC)C(CNC(=O)CN1C(=O)NC(C)(c2ccc(OC)cc2)C1=O)c1cccc(OC)c1
• InChI: InChI=1S/C26H34N4O5/c1-6-29(7-2)22(18-9-8-10-21(15-18)35-5)16-27-23(31)17-30-24(32)26(3,28-25(30)33)19-11-13-20(34-4)14-12-19/h8-15,22H,6-7,16-17H2,1-5H3,(H,27,31)(H,28,33)
• InChIKey: RYNBPAGUGSCIJE-UHFFFAOYSA-N
• XLogP: 2.67
• TPSA: 100.21 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 6
• Rotatable Bonds: 11
• Heavy Atoms: 35
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	482.58
LogP ≤ 5	2.67
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide?

The IUPAC name of N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide (CID 46447043) is N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide.

What is the SMILES notation for N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide?

The canonical SMILES for N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide is CCN(CC)C(CNC(=O)CN1C(=O)NC(C)(c2ccc(OC)cc2)C1=O)c1cccc(OC)c1.

What is the InChIKey of N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide?

The InChIKey is RYNBPAGUGSCIJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H34N4O5/c1-6-29(7-2)22(18-9-8-10-21(15-18)35-5)16-27-23(31)17-30-24(32)26(3,28-25(30)33)19-11-13-20(34-4)14-12-19/h8-15,22H,6-7,16-17H2,1-5H3,(H,27,31)(H,28,33).

What are the key properties of N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide?

N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide has a molecular weight of 482.58 g/mol, XLogP of 2.67, 11 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide is sourced from PubChem (CID 46447043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).