6-methylspiro[1,2-dihydroindene-3,5'-imidazolidine]-2',4'-dione

C12H12N2O2 — CID 21162203

IUPAC6-methylspiro[1,2-dihydroindene-3,5'-imidazolidine]-2',4'-dione
SMILESCc1ccc2c(c1)CCC21NC(=O)NC1=O
InChIInChI=1S/C12H12N2O2/c1-7-2-3-9-8(6-7)4-5-12(9)10(15)13-11(16)14-12/h2-3,6H,4-5H2,1H3,(H2,13,14,15,16)
InChIKeyZFLNOKMYQNNENE-UHFFFAOYSA-N
MW216.24 g/mol
LogP0.98
Rot. Bonds

About 6-methylspiro[1,2-dihydroindene-3,5'-imidazolidine]-2',4'-dione

6-methylspiro[1,2-dihydroindene-3,5'-imidazolidine]-2',4'-dione (PubChem CID 21162203) has the molecular formula C12H12N2O2 and a molecular weight of 216.24 g/mol. Its IUPAC name is 6-methylspiro[1,2-dihydroindene-3,5'-imidazolidine]-2',4'-dione.

Molecular Properties

Compound Name6-methylspiro[1,2-dihydroindene-3,5'-imidazolidine]-2',4'-dione
PubChem CID21162203
Molecular FormulaC12H12N2O2
Molecular Weight216.24 g/mol
Exact Mass216.09
IUPAC Name6-methylspiro[1,2-dihydroindene-3,5'-imidazolidine]-2',4'-dione
SMILESCc1ccc2c(c1)CCC21NC(=O)NC1=O
InChIInChI=1S/C12H12N2O2/c1-7-2-3-9-8(6-7)4-5-12(9)10(15)13-11(16)14-12/h2-3,6H,4-5H2,1H3,(H2,13,14,15,16)
InChIKeyZFLNOKMYQNNENE-UHFFFAOYSA-N
XLogP0.98
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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-methylspiro[1,2-dihydroindene-3,5'-imidazolidine]-2',4'-dione?
The IUPAC name of 6-methylspiro[1,2-dihydroindene-3,5'-imidazolidine]-2',4'-dione (CID 21162203) is 6-methylspiro[1,2-dihydroindene-3,5'-imidazolidine]-2',4'-dione.
What is the SMILES notation for 6-methylspiro[1,2-dihydroindene-3,5'-imidazolidine]-2',4'-dione?
The canonical SMILES for 6-methylspiro[1,2-dihydroindene-3,5'-imidazolidine]-2',4'-dione is Cc1ccc2c(c1)CCC21NC(=O)NC1=O.
What is the InChIKey of 6-methylspiro[1,2-dihydroindene-3,5'-imidazolidine]-2',4'-dione?
The InChIKey is ZFLNOKMYQNNENE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2/c1-7-2-3-9-8(6-7)4-5-12(9)10(15)13-11(16)14-12/h2-3,6H,4-5H2,1H3,(H2,13,14,15,16).
What are the key properties of 6-methylspiro[1,2-dihydroindene-3,5'-imidazolidine]-2',4'-dione?
6-methylspiro[1,2-dihydroindene-3,5'-imidazolidine]-2',4'-dione has a molecular weight of 216.24 g/mol, XLogP of 0.98, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methylspiro[1,2-dihydroindene-3,5'-imidazolidine]-2',4'-dione is sourced from PubChem (CID 21162203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).