methoxymethane;3-naphthalen-1-yl-N-[2-oxo-2-[[1-oxo-3-(2-oxopyrrolidin-3-yl)propan-2-yl]amino]ethyl]-2-[(2-phenylacetyl)amino]propanamide

C32H38N4O6 — CID 145401650

About methoxymethane;3-naphthalen-1-yl-N-[2-oxo-2-[[1-oxo-3-(2-oxopyrrolidin-3-yl)propan-2-yl]amino]ethyl]-2-[(2-phenylacetyl)amino]propanamide

methoxymethane;3-naphthalen-1-yl-N-[2-oxo-2-[[1-oxo-3-(2-oxopyrrolidin-3-yl)propan-2-yl]amino]ethyl]-2-[(2-phenylacetyl)amino]propanamide (PubChem CID 145401650) has the molecular formula C32H38N4O6 and a molecular weight of 574.68 g/mol. Its IUPAC name is methoxymethane;3-naphthalen-1-yl-N-[2-oxo-2-[[1-oxo-3-(2-oxopyrrolidin-3-yl)propan-2-yl]amino]ethyl]-2-[(2-phenylacetyl)amino]propanamide.

Molecular Properties

• Compound Name: methoxymethane;3-naphthalen-1-yl-N-[2-oxo-2-[[1-oxo-3-(2-oxopyrrolidin-3-yl)propan-2-yl]amino]ethyl]-2-[(2-phenylacetyl)amino]propanamide
• PubChem CID: 145401650
• Molecular Formula: C32H38N4O6
• Molecular Weight: 574.68 g/mol
• Exact Mass: 574.28
• IUPAC Name: methoxymethane;3-naphthalen-1-yl-N-[2-oxo-2-[[1-oxo-3-(2-oxopyrrolidin-3-yl)propan-2-yl]amino]ethyl]-2-[(2-phenylacetyl)amino]propanamide
• SMILES: COC.O=CC(CC1CCNC1=O)NC(=O)CNC(=O)C(Cc1cccc2ccccc12)NC(=O)Cc1ccccc1
• InChI: InChI=1S/C30H32N4O5.C2H6O/c35-19-24(16-23-13-14-31-29(23)38)33-28(37)18-32-30(39)26(34-27(36)15-20-7-2-1-3-8-20)17-22-11-6-10-21-9-4-5-12-25(21)22;1-3-2/h1-12,19,23-24,26H,13-18H2,(H,31,38)(H,32,39)(H,33,37)(H,34,36);1-2H3
• InChIKey: FSSUOAFFJLFBTN-UHFFFAOYSA-N
• XLogP: 1.70
• TPSA: 142.70 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 6
• Rotatable Bonds: 12
• Heavy Atoms: 42
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	574.68
LogP ≤ 5	1.70
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of methoxymethane;3-naphthalen-1-yl-N-[2-oxo-2-[[1-oxo-3-(2-oxopyrrolidin-3-yl)propan-2-yl]amino]ethyl]-2-[(2-phenylacetyl)amino]propanamide?

The IUPAC name of methoxymethane;3-naphthalen-1-yl-N-[2-oxo-2-[[1-oxo-3-(2-oxopyrrolidin-3-yl)propan-2-yl]amino]ethyl]-2-[(2-phenylacetyl)amino]propanamide (CID 145401650) is methoxymethane;3-naphthalen-1-yl-N-[2-oxo-2-[[1-oxo-3-(2-oxopyrrolidin-3-yl)propan-2-yl]amino]ethyl]-2-[(2-phenylacetyl)amino]propanamide.

What is the SMILES notation for methoxymethane;3-naphthalen-1-yl-N-[2-oxo-2-[[1-oxo-3-(2-oxopyrrolidin-3-yl)propan-2-yl]amino]ethyl]-2-[(2-phenylacetyl)amino]propanamide?

The canonical SMILES for methoxymethane;3-naphthalen-1-yl-N-[2-oxo-2-[[1-oxo-3-(2-oxopyrrolidin-3-yl)propan-2-yl]amino]ethyl]-2-[(2-phenylacetyl)amino]propanamide is COC.O=CC(CC1CCNC1=O)NC(=O)CNC(=O)C(Cc1cccc2ccccc12)NC(=O)Cc1ccccc1.

What is the InChIKey of methoxymethane;3-naphthalen-1-yl-N-[2-oxo-2-[[1-oxo-3-(2-oxopyrrolidin-3-yl)propan-2-yl]amino]ethyl]-2-[(2-phenylacetyl)amino]propanamide?

The InChIKey is FSSUOAFFJLFBTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H32N4O5.C2H6O/c35-19-24(16-23-13-14-31-29(23)38)33-28(37)18-32-30(39)26(34-27(36)15-20-7-2-1-3-8-20)17-22-11-6-10-21-9-4-5-12-25(21)22;1-3-2/h1-12,19,23-24,26H,13-18H2,(H,31,38)(H,32,39)(H,33,37)(H,34,36);1-2H3.

What are the key properties of methoxymethane;3-naphthalen-1-yl-N-[2-oxo-2-[[1-oxo-3-(2-oxopyrrolidin-3-yl)propan-2-yl]amino]ethyl]-2-[(2-phenylacetyl)amino]propanamide?

methoxymethane;3-naphthalen-1-yl-N-[2-oxo-2-[[1-oxo-3-(2-oxopyrrolidin-3-yl)propan-2-yl]amino]ethyl]-2-[(2-phenylacetyl)amino]propanamide has a molecular weight of 574.68 g/mol, XLogP of 1.70, 12 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for methoxymethane;3-naphthalen-1-yl-N-[2-oxo-2-[[1-oxo-3-(2-oxopyrrolidin-3-yl)propan-2-yl]amino]ethyl]-2-[(2-phenylacetyl)amino]propanamide is sourced from PubChem (CID 145401650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).