(3R)-6-bromospiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione

C12H10BrNO2 — CID 124572209

IUPAC(3R)-6-bromospiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione
SMILESO=C1C[C@@]2(CCc3cc(Br)ccc32)C(=O)N1
InChIInChI=1S/C12H10BrNO2/c13-8-1-2-9-7(5-8)3-4-12(9)6-10(15)14-11(12)16/h1-2,5H,3-4,6H2,(H,14,15,16)/t12-/m1/s1
InChIKeyZSEXZGPBZMYCND-GFCCVEGCSA-N
MW280.12 g/mol
LogP1.68
Rot. Bonds

About (3R)-6-bromospiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione

(3R)-6-bromospiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione (PubChem CID 124572209) has the molecular formula C12H10BrNO2 and a molecular weight of 280.12 g/mol. Its IUPAC name is (3R)-6-bromospiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione.

Molecular Properties

Compound Name(3R)-6-bromospiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione
PubChem CID124572209
Molecular FormulaC12H10BrNO2
Molecular Weight280.12 g/mol
Exact Mass278.99
IUPAC Name(3R)-6-bromospiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione
SMILESO=C1C[C@@]2(CCc3cc(Br)ccc32)C(=O)N1
InChIInChI=1S/C12H10BrNO2/c13-8-1-2-9-7(5-8)3-4-12(9)6-10(15)14-11(12)16/h1-2,5H,3-4,6H2,(H,14,15,16)/t12-/m1/s1
InChIKeyZSEXZGPBZMYCND-GFCCVEGCSA-N
XLogP1.68
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.12
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

7-bromospiro[2,4-dihydro-1H-naphthalene-3,4'-piperidine]-2',6'-dione
CID 63632927
spiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]-2',5'-dione
CID 4230334
6-bromospiro[1,2-dihydroindene-3,5'-imidazolidine]-2',4'-dione
CID 10869704
(3R)-6-bromospiro[1,2-dihydroindene-3,5'-imidazolidine]-2',4'-dione
CID 118958026
(4aR,10bR)-8-bromo-10b-methyl-1,2,4,4a,5,6-hexahydrobenzo[f]quinolin-3-one
CID 11119935
6-bromospiro[1,2-dihydroindene-3,1'-cyclopropane];ethane
CID 145339117
6-bromospiro[1H-indene-3,4'-oxane]-2-one
CID 58154272
7-bromo-3,3,4,4-tetramethyl-1,2-dihydronaphthalene
CID 175335793
6-bromospiro[1H-indene-3,3'-thietane]-2-one
CID 58221476
(3S)-7-nitrospiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione
CID 164939916
(1S)-1-amino-5-bromo-2,3-dihydroindene-1-carboxylic acid
CID 118956982
6-bromo-4'-hydroxyspiro[1H-indole-3,1'-cyclohexane]-2-one
CID 66958239

Frequently Asked Questions

What is the IUPAC name of (3R)-6-bromospiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione?
The IUPAC name of (3R)-6-bromospiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione (CID 124572209) is (3R)-6-bromospiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione.
What is the SMILES notation for (3R)-6-bromospiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione?
The canonical SMILES for (3R)-6-bromospiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione is O=C1C[C@@]2(CCc3cc(Br)ccc32)C(=O)N1.
What is the InChIKey of (3R)-6-bromospiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione?
The InChIKey is ZSEXZGPBZMYCND-GFCCVEGCSA-N. The full InChI is InChI=1S/C12H10BrNO2/c13-8-1-2-9-7(5-8)3-4-12(9)6-10(15)14-11(12)16/h1-2,5H,3-4,6H2,(H,14,15,16)/t12-/m1/s1.
What are the key properties of (3R)-6-bromospiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione?
(3R)-6-bromospiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione has a molecular weight of 280.12 g/mol, XLogP of 1.68, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-6-bromospiro[1,2-dihydroindene-3,3'-pyrrolidine]-2',5'-dione is sourced from PubChem (CID 124572209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).