2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(furan-2-ylmethyl)-N-methylacetamide

C23H21N3O4 — CID 9171870

IUPAC2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(furan-2-ylmethyl)-N-methylacetamide
SMILESCN(Cc1ccco1)C(=O)CN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O
InChIInChI=1S/C23H21N3O4/c1-25(15-19-13-8-14-30-19)20(27)16-26-21(28)23(24-22(26)29,17-9-4-2-5-10-17)18-11-6-3-7-12-18/h2-14H,15-16H2,1H3,(H,24,29)
InChIKeyDBYRVASJSAQIFM-UHFFFAOYSA-N
MW403.44 g/mol
LogP2.73
Rot. Bonds6

About 2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(furan-2-ylmethyl)-N-methylacetamide

2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(furan-2-ylmethyl)-N-methylacetamide (PubChem CID 9171870) has the molecular formula C23H21N3O4 and a molecular weight of 403.44 g/mol. Its IUPAC name is 2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(furan-2-ylmethyl)-N-methylacetamide.

Molecular Properties

Compound Name2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(furan-2-ylmethyl)-N-methylacetamide
PubChem CID9171870
Molecular FormulaC23H21N3O4
Molecular Weight403.44 g/mol
Exact Mass403.15
IUPAC Name2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(furan-2-ylmethyl)-N-methylacetamide
SMILESCN(Cc1ccco1)C(=O)CN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O
InChIInChI=1S/C23H21N3O4/c1-25(15-19-13-8-14-30-19)20(27)16-26-21(28)23(24-22(26)29,17-9-4-2-5-10-17)18-11-6-3-7-12-18/h2-14H,15-16H2,1H3,(H,24,29)
InChIKeyDBYRVASJSAQIFM-UHFFFAOYSA-N
XLogP2.73
TPSA82.86 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.44
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(furan-2-ylmethyl)-N-methylacetamide?
The IUPAC name of 2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(furan-2-ylmethyl)-N-methylacetamide (CID 9171870) is 2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(furan-2-ylmethyl)-N-methylacetamide.
What is the SMILES notation for 2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(furan-2-ylmethyl)-N-methylacetamide?
The canonical SMILES for 2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(furan-2-ylmethyl)-N-methylacetamide is CN(Cc1ccco1)C(=O)CN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O.
What is the InChIKey of 2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(furan-2-ylmethyl)-N-methylacetamide?
The InChIKey is DBYRVASJSAQIFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N3O4/c1-25(15-19-13-8-14-30-19)20(27)16-26-21(28)23(24-22(26)29,17-9-4-2-5-10-17)18-11-6-3-7-12-18/h2-14H,15-16H2,1H3,(H,24,29).
What are the key properties of 2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(furan-2-ylmethyl)-N-methylacetamide?
2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(furan-2-ylmethyl)-N-methylacetamide has a molecular weight of 403.44 g/mol, XLogP of 2.73, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(furan-2-ylmethyl)-N-methylacetamide is sourced from PubChem (CID 9171870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).