6,8-dimethylspiro[2,3-dihydrochromene-4,5'-imidazolidine]-2',4'-dione

C13H14N2O3 — CID 15572756

IUPAC6,8-dimethylspiro[2,3-dihydrochromene-4,5'-imidazolidine]-2',4'-dione
SMILESCc1cc(C)c2c(c1)C1(CCO2)NC(=O)NC1=O
InChIInChI=1S/C13H14N2O3/c1-7-5-8(2)10-9(6-7)13(3-4-18-10)11(16)14-12(17)15-13/h5-6H,3-4H2,1-2H3,(H2,14,15,16,17)
InChIKeyBYFIQXGIDZTPHX-UHFFFAOYSA-N
MW246.27 g/mol
LogP1.12
Rot. Bonds

About 6,8-dimethylspiro[2,3-dihydrochromene-4,5'-imidazolidine]-2',4'-dione

6,8-dimethylspiro[2,3-dihydrochromene-4,5'-imidazolidine]-2',4'-dione (PubChem CID 15572756) has the molecular formula C13H14N2O3 and a molecular weight of 246.27 g/mol. Its IUPAC name is 6,8-dimethylspiro[2,3-dihydrochromene-4,5'-imidazolidine]-2',4'-dione.

Molecular Properties

Compound Name6,8-dimethylspiro[2,3-dihydrochromene-4,5'-imidazolidine]-2',4'-dione
PubChem CID15572756
Molecular FormulaC13H14N2O3
Molecular Weight246.27 g/mol
Exact Mass246.10
IUPAC Name6,8-dimethylspiro[2,3-dihydrochromene-4,5'-imidazolidine]-2',4'-dione
SMILESCc1cc(C)c2c(c1)C1(CCO2)NC(=O)NC1=O
InChIInChI=1S/C13H14N2O3/c1-7-5-8(2)10-9(6-7)13(3-4-18-10)11(16)14-12(17)15-13/h5-6H,3-4H2,1-2H3,(H2,14,15,16,17)
InChIKeyBYFIQXGIDZTPHX-UHFFFAOYSA-N
XLogP1.12
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 51.12
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 6,8-dimethylspiro[2,3-dihydrochromene-4,5'-imidazolidine]-2',4'-dione?
The IUPAC name of 6,8-dimethylspiro[2,3-dihydrochromene-4,5'-imidazolidine]-2',4'-dione (CID 15572756) is 6,8-dimethylspiro[2,3-dihydrochromene-4,5'-imidazolidine]-2',4'-dione.
What is the SMILES notation for 6,8-dimethylspiro[2,3-dihydrochromene-4,5'-imidazolidine]-2',4'-dione?
The canonical SMILES for 6,8-dimethylspiro[2,3-dihydrochromene-4,5'-imidazolidine]-2',4'-dione is Cc1cc(C)c2c(c1)C1(CCO2)NC(=O)NC1=O.
What is the InChIKey of 6,8-dimethylspiro[2,3-dihydrochromene-4,5'-imidazolidine]-2',4'-dione?
The InChIKey is BYFIQXGIDZTPHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O3/c1-7-5-8(2)10-9(6-7)13(3-4-18-10)11(16)14-12(17)15-13/h5-6H,3-4H2,1-2H3,(H2,14,15,16,17).
What are the key properties of 6,8-dimethylspiro[2,3-dihydrochromene-4,5'-imidazolidine]-2',4'-dione?
6,8-dimethylspiro[2,3-dihydrochromene-4,5'-imidazolidine]-2',4'-dione has a molecular weight of 246.27 g/mol, XLogP of 1.12, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6,8-dimethylspiro[2,3-dihydrochromene-4,5'-imidazolidine]-2',4'-dione is sourced from PubChem (CID 15572756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).