spiro[2,3-dihydrochromene-4,5'-imidazolidine]-2',4'-dione

C11H10N2O3 — CID 4575557

IUPACspiro[2,3-dihydrochromene-4,5'-imidazolidine]-2',4'-dione
SMILESO=C1NC(=O)C2(CCOc3ccccc32)N1
InChIInChI=1S/C11H10N2O3/c14-9-11(13-10(15)12-9)5-6-16-8-4-2-1-3-7(8)11/h1-4H,5-6H2,(H2,12,13,14,15)
InChIKeyYEGZRRJAGUJLDV-UHFFFAOYSA-N
MW218.21 g/mol
LogP0.50
Rot. Bonds

About spiro[2,3-dihydrochromene-4,5'-imidazolidine]-2',4'-dione

spiro[2,3-dihydrochromene-4,5'-imidazolidine]-2',4'-dione (PubChem CID 4575557) has the molecular formula C11H10N2O3 and a molecular weight of 218.21 g/mol. Its IUPAC name is spiro[2,3-dihydrochromene-4,5'-imidazolidine]-2',4'-dione.

Molecular Properties

Compound Namespiro[2,3-dihydrochromene-4,5'-imidazolidine]-2',4'-dione
PubChem CID4575557
Molecular FormulaC11H10N2O3
Molecular Weight218.21 g/mol
Exact Mass218.07
IUPAC Namespiro[2,3-dihydrochromene-4,5'-imidazolidine]-2',4'-dione
SMILESO=C1NC(=O)C2(CCOc3ccccc32)N1
InChIInChI=1S/C11H10N2O3/c14-9-11(13-10(15)12-9)5-6-16-8-4-2-1-3-7(8)11/h1-4H,5-6H2,(H2,12,13,14,15)
InChIKeyYEGZRRJAGUJLDV-UHFFFAOYSA-N
XLogP0.50
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.21
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of spiro[2,3-dihydrochromene-4,5'-imidazolidine]-2',4'-dione?
The IUPAC name of spiro[2,3-dihydrochromene-4,5'-imidazolidine]-2',4'-dione (CID 4575557) is spiro[2,3-dihydrochromene-4,5'-imidazolidine]-2',4'-dione.
What is the SMILES notation for spiro[2,3-dihydrochromene-4,5'-imidazolidine]-2',4'-dione?
The canonical SMILES for spiro[2,3-dihydrochromene-4,5'-imidazolidine]-2',4'-dione is O=C1NC(=O)C2(CCOc3ccccc32)N1.
What is the InChIKey of spiro[2,3-dihydrochromene-4,5'-imidazolidine]-2',4'-dione?
The InChIKey is YEGZRRJAGUJLDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O3/c14-9-11(13-10(15)12-9)5-6-16-8-4-2-1-3-7(8)11/h1-4H,5-6H2,(H2,12,13,14,15).
What are the key properties of spiro[2,3-dihydrochromene-4,5'-imidazolidine]-2',4'-dione?
spiro[2,3-dihydrochromene-4,5'-imidazolidine]-2',4'-dione has a molecular weight of 218.21 g/mol, XLogP of 0.50, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[2,3-dihydrochromene-4,5'-imidazolidine]-2',4'-dione is sourced from PubChem (CID 4575557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).