N-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]acetamide

C19H22N4O3S — CID 8804417

About N-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]acetamide

N-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]acetamide (PubChem CID 8804417) has the molecular formula C19H22N4O3S and a molecular weight of 386.48 g/mol. Its IUPAC name is N-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]acetamide.

Molecular Properties

• Compound Name: N-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]acetamide
• PubChem CID: 8804417
• Molecular Formula: C19H22N4O3S
• Molecular Weight: 386.48 g/mol
• Exact Mass: 386.14
• IUPAC Name: N-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]acetamide
• SMILES: Cc1ccsc1CN(C)CC(=O)NN1C(=O)N[C@](C)(c2ccccc2)C1=O
• InChI: InChI=1S/C19H22N4O3S/c1-13-9-10-27-15(13)11-22(3)12-16(24)21-23-17(25)19(2,20-18(23)26)14-7-5-4-6-8-14/h4-10H,11-12H2,1-3H3,(H,20,26)(H,21,24)/t19-/m1/s1
• InChIKey: FUOPONJEQWDVDP-LJQANCHMSA-N
• XLogP: 1.99
• TPSA: 81.75 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 5
• Rotatable Bonds: 6
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	386.48
LogP ≤ 5	1.99
H-Bond Donors ≤ 5	2
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 N-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]acetamide?

The IUPAC name of N-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]acetamide (CID 8804417) is N-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]acetamide.

What is the SMILES notation for N-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]acetamide?

The canonical SMILES for N-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]acetamide is Cc1ccsc1CN(C)CC(=O)NN1C(=O)N[C@](C)(c2ccccc2)C1=O.

What is the InChIKey of N-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]acetamide?

The InChIKey is FUOPONJEQWDVDP-LJQANCHMSA-N. The full InChI is InChI=1S/C19H22N4O3S/c1-13-9-10-27-15(13)11-22(3)12-16(24)21-23-17(25)19(2,20-18(23)26)14-7-5-4-6-8-14/h4-10H,11-12H2,1-3H3,(H,20,26)(H,21,24)/t19-/m1/s1.

What are the key properties of N-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]acetamide?

N-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]acetamide has a molecular weight of 386.48 g/mol, XLogP of 1.99, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]acetamide is sourced from PubChem (CID 8804417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).