2-fluoro-7-(2-methylcyclopropyl)spiro[fluorene-9,5'-imidazolidine]-2',4'-dione

C19H15FN2O2 — CID 138496483

IUPAC2-fluoro-7-(2-methylcyclopropyl)spiro[fluorene-9,5'-imidazolidine]-2',4'-dione
SMILESCC1CC1c1ccc2c(c1)C1(NC(=O)NC1=O)c1cc(F)ccc1-2
InChIInChI=1S/C19H15FN2O2/c1-9-6-14(9)10-2-4-12-13-5-3-11(20)8-16(13)19(15(12)7-10)17(23)21-18(24)22-19/h2-5,7-9,14H,6H2,1H3,(H2,21,22,23,24)
InChIKeyIRWPQENAVHBDNF-UHFFFAOYSA-N
MW322.34 g/mol
LogP3.01
Rot. Bonds1

About 2-fluoro-7-(2-methylcyclopropyl)spiro[fluorene-9,5'-imidazolidine]-2',4'-dione

2-fluoro-7-(2-methylcyclopropyl)spiro[fluorene-9,5'-imidazolidine]-2',4'-dione (PubChem CID 138496483) has the molecular formula C19H15FN2O2 and a molecular weight of 322.34 g/mol. Its IUPAC name is 2-fluoro-7-(2-methylcyclopropyl)spiro[fluorene-9,5'-imidazolidine]-2',4'-dione.

Molecular Properties

Compound Name2-fluoro-7-(2-methylcyclopropyl)spiro[fluorene-9,5'-imidazolidine]-2',4'-dione
PubChem CID138496483
Molecular FormulaC19H15FN2O2
Molecular Weight322.34 g/mol
Exact Mass322.11
IUPAC Name2-fluoro-7-(2-methylcyclopropyl)spiro[fluorene-9,5'-imidazolidine]-2',4'-dione
SMILESCC1CC1c1ccc2c(c1)C1(NC(=O)NC1=O)c1cc(F)ccc1-2
InChIInChI=1S/C19H15FN2O2/c1-9-6-14(9)10-2-4-12-13-5-3-11(20)8-16(13)19(15(12)7-10)17(23)21-18(24)22-19/h2-5,7-9,14H,6H2,1H3,(H2,21,22,23,24)
InChIKeyIRWPQENAVHBDNF-UHFFFAOYSA-N
XLogP3.01
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.34
LogP ≤ 53.01
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-fluoro-7-(2-methylcyclopropyl)spiro[fluorene-9,5'-imidazolidine]-2',4'-dione?
The IUPAC name of 2-fluoro-7-(2-methylcyclopropyl)spiro[fluorene-9,5'-imidazolidine]-2',4'-dione (CID 138496483) is 2-fluoro-7-(2-methylcyclopropyl)spiro[fluorene-9,5'-imidazolidine]-2',4'-dione.
What is the SMILES notation for 2-fluoro-7-(2-methylcyclopropyl)spiro[fluorene-9,5'-imidazolidine]-2',4'-dione?
The canonical SMILES for 2-fluoro-7-(2-methylcyclopropyl)spiro[fluorene-9,5'-imidazolidine]-2',4'-dione is CC1CC1c1ccc2c(c1)C1(NC(=O)NC1=O)c1cc(F)ccc1-2.
What is the InChIKey of 2-fluoro-7-(2-methylcyclopropyl)spiro[fluorene-9,5'-imidazolidine]-2',4'-dione?
The InChIKey is IRWPQENAVHBDNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FN2O2/c1-9-6-14(9)10-2-4-12-13-5-3-11(20)8-16(13)19(15(12)7-10)17(23)21-18(24)22-19/h2-5,7-9,14H,6H2,1H3,(H2,21,22,23,24).
What are the key properties of 2-fluoro-7-(2-methylcyclopropyl)spiro[fluorene-9,5'-imidazolidine]-2',4'-dione?
2-fluoro-7-(2-methylcyclopropyl)spiro[fluorene-9,5'-imidazolidine]-2',4'-dione has a molecular weight of 322.34 g/mol, XLogP of 3.01, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-7-(2-methylcyclopropyl)spiro[fluorene-9,5'-imidazolidine]-2',4'-dione is sourced from PubChem (CID 138496483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).