3'-[2-(2-chlorophenyl)ethyl]spiro[1,3-dihydroindene-2,5'-imidazolidine]-2',4'-dione

C19H17ClN2O2 — CID 166202379

IUPAC3'-[2-(2-chlorophenyl)ethyl]spiro[1,3-dihydroindene-2,5'-imidazolidine]-2',4'-dione
SMILESO=C1NC2(Cc3ccccc3C2)C(=O)N1CCc1ccccc1Cl
InChIInChI=1S/C19H17ClN2O2/c20-16-8-4-3-5-13(16)9-10-22-17(23)19(21-18(22)24)11-14-6-1-2-7-15(14)12-19/h1-8H,9-12H2,(H,21,24)
InChIKeyMAXFMOOBBYLBSC-UHFFFAOYSA-N
MW340.81 g/mol
LogP2.97
Rot. Bonds3

About 3'-[2-(2-chlorophenyl)ethyl]spiro[1,3-dihydroindene-2,5'-imidazolidine]-2',4'-dione

3'-[2-(2-chlorophenyl)ethyl]spiro[1,3-dihydroindene-2,5'-imidazolidine]-2',4'-dione (PubChem CID 166202379) has the molecular formula C19H17ClN2O2 and a molecular weight of 340.81 g/mol. Its IUPAC name is 3'-[2-(2-chlorophenyl)ethyl]spiro[1,3-dihydroindene-2,5'-imidazolidine]-2',4'-dione.

Molecular Properties

Compound Name3'-[2-(2-chlorophenyl)ethyl]spiro[1,3-dihydroindene-2,5'-imidazolidine]-2',4'-dione
PubChem CID166202379
Molecular FormulaC19H17ClN2O2
Molecular Weight340.81 g/mol
Exact Mass340.10
IUPAC Name3'-[2-(2-chlorophenyl)ethyl]spiro[1,3-dihydroindene-2,5'-imidazolidine]-2',4'-dione
SMILESO=C1NC2(Cc3ccccc3C2)C(=O)N1CCc1ccccc1Cl
InChIInChI=1S/C19H17ClN2O2/c20-16-8-4-3-5-13(16)9-10-22-17(23)19(21-18(22)24)11-14-6-1-2-7-15(14)12-19/h1-8H,9-12H2,(H,21,24)
InChIKeyMAXFMOOBBYLBSC-UHFFFAOYSA-N
XLogP2.97
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.81
LogP ≤ 52.97
H-Bond Donors ≤ 51
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 3'-[2-(2-chlorophenyl)ethyl]spiro[1,3-dihydroindene-2,5'-imidazolidine]-2',4'-dione?
The IUPAC name of 3'-[2-(2-chlorophenyl)ethyl]spiro[1,3-dihydroindene-2,5'-imidazolidine]-2',4'-dione (CID 166202379) is 3'-[2-(2-chlorophenyl)ethyl]spiro[1,3-dihydroindene-2,5'-imidazolidine]-2',4'-dione.
What is the SMILES notation for 3'-[2-(2-chlorophenyl)ethyl]spiro[1,3-dihydroindene-2,5'-imidazolidine]-2',4'-dione?
The canonical SMILES for 3'-[2-(2-chlorophenyl)ethyl]spiro[1,3-dihydroindene-2,5'-imidazolidine]-2',4'-dione is O=C1NC2(Cc3ccccc3C2)C(=O)N1CCc1ccccc1Cl.
What is the InChIKey of 3'-[2-(2-chlorophenyl)ethyl]spiro[1,3-dihydroindene-2,5'-imidazolidine]-2',4'-dione?
The InChIKey is MAXFMOOBBYLBSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClN2O2/c20-16-8-4-3-5-13(16)9-10-22-17(23)19(21-18(22)24)11-14-6-1-2-7-15(14)12-19/h1-8H,9-12H2,(H,21,24).
What are the key properties of 3'-[2-(2-chlorophenyl)ethyl]spiro[1,3-dihydroindene-2,5'-imidazolidine]-2',4'-dione?
3'-[2-(2-chlorophenyl)ethyl]spiro[1,3-dihydroindene-2,5'-imidazolidine]-2',4'-dione has a molecular weight of 340.81 g/mol, XLogP of 2.97, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3'-[2-(2-chlorophenyl)ethyl]spiro[1,3-dihydroindene-2,5'-imidazolidine]-2',4'-dione is sourced from PubChem (CID 166202379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).