5-(2,3-dihydro-1H-inden-2-yl)imidazolidine-2,4-dione

C12H12N2O2 — CID 11715491

IUPAC5-(2,3-dihydro-1H-inden-2-yl)imidazolidine-2,4-dione
SMILESO=C1NC(=O)C(C2Cc3ccccc3C2)N1
InChIInChI=1S/C12H12N2O2/c15-11-10(13-12(16)14-11)9-5-7-3-1-2-4-8(7)6-9/h1-4,9-10H,5-6H2,(H2,13,14,15,16)
InChIKeyZNRASHCTAVTQBT-UHFFFAOYSA-N
MW216.24 g/mol
LogP0.61
Rot. Bonds1

About 5-(2,3-dihydro-1H-inden-2-yl)imidazolidine-2,4-dione

5-(2,3-dihydro-1H-inden-2-yl)imidazolidine-2,4-dione (PubChem CID 11715491) has the molecular formula C12H12N2O2 and a molecular weight of 216.24 g/mol. Its IUPAC name is 5-(2,3-dihydro-1H-inden-2-yl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name5-(2,3-dihydro-1H-inden-2-yl)imidazolidine-2,4-dione
PubChem CID11715491
Molecular FormulaC12H12N2O2
Molecular Weight216.24 g/mol
Exact Mass216.09
IUPAC Name5-(2,3-dihydro-1H-inden-2-yl)imidazolidine-2,4-dione
SMILESO=C1NC(=O)C(C2Cc3ccccc3C2)N1
InChIInChI=1S/C12H12N2O2/c15-11-10(13-12(16)14-11)9-5-7-3-1-2-4-8(7)6-9/h1-4,9-10H,5-6H2,(H2,13,14,15,16)
InChIKeyZNRASHCTAVTQBT-UHFFFAOYSA-N
XLogP0.61
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 50.61
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 5-(2,3-dihydro-1H-inden-2-yl)imidazolidine-2,4-dione?
The IUPAC name of 5-(2,3-dihydro-1H-inden-2-yl)imidazolidine-2,4-dione (CID 11715491) is 5-(2,3-dihydro-1H-inden-2-yl)imidazolidine-2,4-dione.
What is the SMILES notation for 5-(2,3-dihydro-1H-inden-2-yl)imidazolidine-2,4-dione?
The canonical SMILES for 5-(2,3-dihydro-1H-inden-2-yl)imidazolidine-2,4-dione is O=C1NC(=O)C(C2Cc3ccccc3C2)N1.
What is the InChIKey of 5-(2,3-dihydro-1H-inden-2-yl)imidazolidine-2,4-dione?
The InChIKey is ZNRASHCTAVTQBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2/c15-11-10(13-12(16)14-11)9-5-7-3-1-2-4-8(7)6-9/h1-4,9-10H,5-6H2,(H2,13,14,15,16).
What are the key properties of 5-(2,3-dihydro-1H-inden-2-yl)imidazolidine-2,4-dione?
5-(2,3-dihydro-1H-inden-2-yl)imidazolidine-2,4-dione has a molecular weight of 216.24 g/mol, XLogP of 0.61, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,3-dihydro-1H-inden-2-yl)imidazolidine-2,4-dione is sourced from PubChem (CID 11715491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).