4-methylspiro[fluorene-9,5'-imidazolidine]-2',4'-dione

C16H12N2O2 — CID 158182679

IUPAC4-methylspiro[fluorene-9,5'-imidazolidine]-2',4'-dione
SMILESCc1cccc2c1-c1ccccc1C21NC(=O)NC1=O
InChIInChI=1S/C16H12N2O2/c1-9-5-4-8-12-13(9)10-6-2-3-7-11(10)16(12)14(19)17-15(20)18-16/h2-8H,1H3,(H2,17,18,19,20)
InChIKeyHBECXBLBLKQTTM-UHFFFAOYSA-N
MW264.28 g/mol
LogP2.06
Rot. Bonds

About 4-methylspiro[fluorene-9,5'-imidazolidine]-2',4'-dione

4-methylspiro[fluorene-9,5'-imidazolidine]-2',4'-dione (PubChem CID 158182679) has the molecular formula C16H12N2O2 and a molecular weight of 264.28 g/mol. Its IUPAC name is 4-methylspiro[fluorene-9,5'-imidazolidine]-2',4'-dione.

Molecular Properties

Compound Name4-methylspiro[fluorene-9,5'-imidazolidine]-2',4'-dione
PubChem CID158182679
Molecular FormulaC16H12N2O2
Molecular Weight264.28 g/mol
Exact Mass264.09
IUPAC Name4-methylspiro[fluorene-9,5'-imidazolidine]-2',4'-dione
SMILESCc1cccc2c1-c1ccccc1C21NC(=O)NC1=O
InChIInChI=1S/C16H12N2O2/c1-9-5-4-8-12-13(9)10-6-2-3-7-11(10)16(12)14(19)17-15(20)18-16/h2-8H,1H3,(H2,17,18,19,20)
InChIKeyHBECXBLBLKQTTM-UHFFFAOYSA-N
XLogP2.06
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.28
LogP ≤ 52.06
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 4-methylspiro[fluorene-9,5'-imidazolidine]-2',4'-dione?
The IUPAC name of 4-methylspiro[fluorene-9,5'-imidazolidine]-2',4'-dione (CID 158182679) is 4-methylspiro[fluorene-9,5'-imidazolidine]-2',4'-dione.
What is the SMILES notation for 4-methylspiro[fluorene-9,5'-imidazolidine]-2',4'-dione?
The canonical SMILES for 4-methylspiro[fluorene-9,5'-imidazolidine]-2',4'-dione is Cc1cccc2c1-c1ccccc1C21NC(=O)NC1=O.
What is the InChIKey of 4-methylspiro[fluorene-9,5'-imidazolidine]-2',4'-dione?
The InChIKey is HBECXBLBLKQTTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N2O2/c1-9-5-4-8-12-13(9)10-6-2-3-7-11(10)16(12)14(19)17-15(20)18-16/h2-8H,1H3,(H2,17,18,19,20).
What are the key properties of 4-methylspiro[fluorene-9,5'-imidazolidine]-2',4'-dione?
4-methylspiro[fluorene-9,5'-imidazolidine]-2',4'-dione has a molecular weight of 264.28 g/mol, XLogP of 2.06, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methylspiro[fluorene-9,5'-imidazolidine]-2',4'-dione is sourced from PubChem (CID 158182679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).