2-cyclopropyl-7-fluorospiro[fluorene-9,5'-imidazolidine]-2',4'-dione

C18H13FN2O2 — CID 138496490

IUPAC2-cyclopropyl-7-fluorospiro[fluorene-9,5'-imidazolidine]-2',4'-dione
SMILESO=C1NC(=O)C2(N1)c1cc(F)ccc1-c1ccc(C3CC3)cc12
InChIInChI=1S/C18H13FN2O2/c19-11-4-6-13-12-5-3-10(9-1-2-9)7-14(12)18(15(13)8-11)16(22)20-17(23)21-18/h3-9H,1-2H2,(H2,20,21,22,23)
InChIKeyYDZFFKAODGORHK-UHFFFAOYSA-N
MW308.31 g/mol
LogP2.77
Rot. Bonds1

About 2-cyclopropyl-7-fluorospiro[fluorene-9,5'-imidazolidine]-2',4'-dione

2-cyclopropyl-7-fluorospiro[fluorene-9,5'-imidazolidine]-2',4'-dione (PubChem CID 138496490) has the molecular formula C18H13FN2O2 and a molecular weight of 308.31 g/mol. Its IUPAC name is 2-cyclopropyl-7-fluorospiro[fluorene-9,5'-imidazolidine]-2',4'-dione.

Molecular Properties

Compound Name2-cyclopropyl-7-fluorospiro[fluorene-9,5'-imidazolidine]-2',4'-dione
PubChem CID138496490
Molecular FormulaC18H13FN2O2
Molecular Weight308.31 g/mol
Exact Mass308.10
IUPAC Name2-cyclopropyl-7-fluorospiro[fluorene-9,5'-imidazolidine]-2',4'-dione
SMILESO=C1NC(=O)C2(N1)c1cc(F)ccc1-c1ccc(C3CC3)cc12
InChIInChI=1S/C18H13FN2O2/c19-11-4-6-13-12-5-3-10(9-1-2-9)7-14(12)18(15(13)8-11)16(22)20-17(23)21-18/h3-9H,1-2H2,(H2,20,21,22,23)
InChIKeyYDZFFKAODGORHK-UHFFFAOYSA-N
XLogP2.77
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.31
LogP ≤ 52.77
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 2-cyclopropyl-7-fluorospiro[fluorene-9,5'-imidazolidine]-2',4'-dione?
The IUPAC name of 2-cyclopropyl-7-fluorospiro[fluorene-9,5'-imidazolidine]-2',4'-dione (CID 138496490) is 2-cyclopropyl-7-fluorospiro[fluorene-9,5'-imidazolidine]-2',4'-dione.
What is the SMILES notation for 2-cyclopropyl-7-fluorospiro[fluorene-9,5'-imidazolidine]-2',4'-dione?
The canonical SMILES for 2-cyclopropyl-7-fluorospiro[fluorene-9,5'-imidazolidine]-2',4'-dione is O=C1NC(=O)C2(N1)c1cc(F)ccc1-c1ccc(C3CC3)cc12.
What is the InChIKey of 2-cyclopropyl-7-fluorospiro[fluorene-9,5'-imidazolidine]-2',4'-dione?
The InChIKey is YDZFFKAODGORHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13FN2O2/c19-11-4-6-13-12-5-3-10(9-1-2-9)7-14(12)18(15(13)8-11)16(22)20-17(23)21-18/h3-9H,1-2H2,(H2,20,21,22,23).
What are the key properties of 2-cyclopropyl-7-fluorospiro[fluorene-9,5'-imidazolidine]-2',4'-dione?
2-cyclopropyl-7-fluorospiro[fluorene-9,5'-imidazolidine]-2',4'-dione has a molecular weight of 308.31 g/mol, XLogP of 2.77, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-7-fluorospiro[fluorene-9,5'-imidazolidine]-2',4'-dione is sourced from PubChem (CID 138496490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).