(1S,3R)-1-phenylspiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione

C18H15NO2 — CID 15870810

IUPAC(1S,3R)-1-phenylspiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione
SMILESO=C1C[C@@]2(C[C@@H](c3ccccc3)c3ccccc32)C(=O)N1
InChIInChI=1S/C18H15NO2/c20-16-11-18(17(21)19-16)10-14(12-6-2-1-3-7-12)13-8-4-5-9-15(13)18/h1-9,14H,10-11H2,(H,19,20,21)/t14-,18+/m0/s1
InChIKeyLSMPRQIQJZZBNI-KBXCAEBGSA-N
MW277.32 g/mol
LogP2.51
Rot. Bonds1

About (1S,3R)-1-phenylspiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione

(1S,3R)-1-phenylspiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione (PubChem CID 15870810) has the molecular formula C18H15NO2 and a molecular weight of 277.32 g/mol. Its IUPAC name is (1S,3R)-1-phenylspiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione.

Molecular Properties

Compound Name(1S,3R)-1-phenylspiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione
PubChem CID15870810
Molecular FormulaC18H15NO2
Molecular Weight277.32 g/mol
Exact Mass277.11
IUPAC Name(1S,3R)-1-phenylspiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione
SMILESO=C1C[C@@]2(C[C@@H](c3ccccc3)c3ccccc32)C(=O)N1
InChIInChI=1S/C18H15NO2/c20-16-11-18(17(21)19-16)10-14(12-6-2-1-3-7-12)13-8-4-5-9-15(13)18/h1-9,14H,10-11H2,(H,19,20,21)/t14-,18+/m0/s1
InChIKeyLSMPRQIQJZZBNI-KBXCAEBGSA-N
XLogP2.51
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (1S,3R)-1-phenylspiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione?
The IUPAC name of (1S,3R)-1-phenylspiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione (CID 15870810) is (1S,3R)-1-phenylspiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione.
What is the SMILES notation for (1S,3R)-1-phenylspiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione?
The canonical SMILES for (1S,3R)-1-phenylspiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione is O=C1C[C@@]2(C[C@@H](c3ccccc3)c3ccccc32)C(=O)N1.
What is the InChIKey of (1S,3R)-1-phenylspiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione?
The InChIKey is LSMPRQIQJZZBNI-KBXCAEBGSA-N. The full InChI is InChI=1S/C18H15NO2/c20-16-11-18(17(21)19-16)10-14(12-6-2-1-3-7-12)13-8-4-5-9-15(13)18/h1-9,14H,10-11H2,(H,19,20,21)/t14-,18+/m0/s1.
What are the key properties of (1S,3R)-1-phenylspiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione?
(1S,3R)-1-phenylspiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione has a molecular weight of 277.32 g/mol, XLogP of 2.51, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,3R)-1-phenylspiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione is sourced from PubChem (CID 15870810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).