2-[(4R)-1-(furan-2-ylmethyl)-2,5-dioxoimidazolidin-4-yl]-N-[(2R,3S)-1-hydroxy-3-methylpentan-2-yl]acetamide

C16H23N3O5 — CID 124862622

About 2-[(4R)-1-(furan-2-ylmethyl)-2,5-dioxoimidazolidin-4-yl]-N-[(2R,3S)-1-hydroxy-3-methylpentan-2-yl]acetamide

2-[(4R)-1-(furan-2-ylmethyl)-2,5-dioxoimidazolidin-4-yl]-N-[(2R,3S)-1-hydroxy-3-methylpentan-2-yl]acetamide (PubChem CID 124862622) has the molecular formula C16H23N3O5 and a molecular weight of 337.38 g/mol. Its IUPAC name is 2-[(4R)-1-(furan-2-ylmethyl)-2,5-dioxoimidazolidin-4-yl]-N-[(2R,3S)-1-hydroxy-3-methylpentan-2-yl]acetamide.

Molecular Properties

• Compound Name: 2-[(4R)-1-(furan-2-ylmethyl)-2,5-dioxoimidazolidin-4-yl]-N-[(2R,3S)-1-hydroxy-3-methylpentan-2-yl]acetamide
• PubChem CID: 124862622
• Molecular Formula: C16H23N3O5
• Molecular Weight: 337.38 g/mol
• Exact Mass: 337.16
• IUPAC Name: 2-[(4R)-1-(furan-2-ylmethyl)-2,5-dioxoimidazolidin-4-yl]-N-[(2R,3S)-1-hydroxy-3-methylpentan-2-yl]acetamide
• SMILES: CC[C@H](C)[C@H](CO)NC(=O)C[C@H]1NC(=O)N(Cc2ccco2)C1=O
• InChI: InChI=1S/C16H23N3O5/c1-3-10(2)13(9-20)17-14(21)7-12-15(22)19(16(23)18-12)8-11-5-4-6-24-11/h4-6,10,12-13,20H,3,7-9H2,1-2H3,(H,17,21)(H,18,23)/t10-,12+,13-/m0/s1
• InChIKey: NVQYZSWUOLIUIR-UHTWSYAYSA-N
• XLogP: 0.61
• TPSA: 111.88 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 5
• Rotatable Bonds: 8
• Heavy Atoms: 24
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	337.38
LogP ≤ 5	0.61
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[(4R)-1-(furan-2-ylmethyl)-2,5-dioxoimidazolidin-4-yl]-N-[(2R,3S)-1-hydroxy-3-methylpentan-2-yl]acetamide?

The IUPAC name of 2-[(4R)-1-(furan-2-ylmethyl)-2,5-dioxoimidazolidin-4-yl]-N-[(2R,3S)-1-hydroxy-3-methylpentan-2-yl]acetamide (CID 124862622) is 2-[(4R)-1-(furan-2-ylmethyl)-2,5-dioxoimidazolidin-4-yl]-N-[(2R,3S)-1-hydroxy-3-methylpentan-2-yl]acetamide.

What is the SMILES notation for 2-[(4R)-1-(furan-2-ylmethyl)-2,5-dioxoimidazolidin-4-yl]-N-[(2R,3S)-1-hydroxy-3-methylpentan-2-yl]acetamide?

The canonical SMILES for 2-[(4R)-1-(furan-2-ylmethyl)-2,5-dioxoimidazolidin-4-yl]-N-[(2R,3S)-1-hydroxy-3-methylpentan-2-yl]acetamide is CC[C@H](C)[C@H](CO)NC(=O)C[C@H]1NC(=O)N(Cc2ccco2)C1=O.

What is the InChIKey of 2-[(4R)-1-(furan-2-ylmethyl)-2,5-dioxoimidazolidin-4-yl]-N-[(2R,3S)-1-hydroxy-3-methylpentan-2-yl]acetamide?

The InChIKey is NVQYZSWUOLIUIR-UHTWSYAYSA-N. The full InChI is InChI=1S/C16H23N3O5/c1-3-10(2)13(9-20)17-14(21)7-12-15(22)19(16(23)18-12)8-11-5-4-6-24-11/h4-6,10,12-13,20H,3,7-9H2,1-2H3,(H,17,21)(H,18,23)/t10-,12+,13-/m0/s1.

What are the key properties of 2-[(4R)-1-(furan-2-ylmethyl)-2,5-dioxoimidazolidin-4-yl]-N-[(2R,3S)-1-hydroxy-3-methylpentan-2-yl]acetamide?

2-[(4R)-1-(furan-2-ylmethyl)-2,5-dioxoimidazolidin-4-yl]-N-[(2R,3S)-1-hydroxy-3-methylpentan-2-yl]acetamide has a molecular weight of 337.38 g/mol, XLogP of 0.61, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[(4R)-1-(furan-2-ylmethyl)-2,5-dioxoimidazolidin-4-yl]-N-[(2R,3S)-1-hydroxy-3-methylpentan-2-yl]acetamide is sourced from PubChem (CID 124862622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).