2'-iminospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-4'-one

C11H10N2O2 — CID 140764521

IUPAC2'-iminospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-4'-one
SMILES[H]/N=C1\NC(=O)C2(CCc3ccccc32)O1
InChIInChI=1S/C11H10N2O2/c12-10-13-9(14)11(15-10)6-5-7-3-1-2-4-8(7)11/h1-4H,5-6H2,(H2,12,13,14)
InChIKeyGSLXBWXDEDBPNI-UHFFFAOYSA-N
MW202.21 g/mol
LogP0.91
Rot. Bonds

About 2'-iminospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-4'-one

2'-iminospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-4'-one (PubChem CID 140764521) has the molecular formula C11H10N2O2 and a molecular weight of 202.21 g/mol. Its IUPAC name is 2'-iminospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-4'-one.

Molecular Properties

Compound Name2'-iminospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-4'-one
PubChem CID140764521
Molecular FormulaC11H10N2O2
Molecular Weight202.21 g/mol
Exact Mass202.07
IUPAC Name2'-iminospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-4'-one
SMILES[H]/N=C1\NC(=O)C2(CCc3ccccc32)O1
InChIInChI=1S/C11H10N2O2/c12-10-13-9(14)11(15-10)6-5-7-3-1-2-4-8(7)11/h1-4H,5-6H2,(H2,12,13,14)
InChIKeyGSLXBWXDEDBPNI-UHFFFAOYSA-N
XLogP0.91
TPSA62.18 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.21
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

spiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-2',4'-dione
CID 13053011
2'-iminospiro[1,3-dihydroindene-2,5'-1,3-oxazolidine]-4'-one
CID 140755972
(5R)-4-iminospiro[1,3-oxazolidine-5,4'-2,3-dihydro-1H-naphthalene]-2-one
CID 164631160
spiro[1H-indole-3,2'-3,4-dihydrochromene]-2-one
CID 166063555
spiro[2,3-dihydro-1H-naphthalene-4,3'-2-benzofuran]-1'-one
CID 19904308
4'-imino-1'-methylspiro[1,2-dihydroindene-3,5'-imidazolidine]-2'-one
CID 138388524
spiro[1,2-dihydroindene-3,3'-pyrrolidine]-2'-one
CID 105442633
spiro[1,2-dihydroindene-3,4'-cyclohexane]-1'-one
CID 22357444
4'-imino-1'-propan-2-ylspiro[2,3-dihydro-1H-naphthalene-4,5'-imidazolidine]-2'-one
CID 138389883
(1R)-5'-hydroxyspiro[3,4-dihydronaphthalene-1,2'-oxolane]-2-one
CID 102323319
3-fluorospiro[2,3-dihydro-1H-naphthalene-4,2'-cyclobutane]-1'-one
CID 102434641
spiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]-2',5'-dione
CID 4230334

Frequently Asked Questions

What is the IUPAC name of 2'-iminospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-4'-one?
The IUPAC name of 2'-iminospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-4'-one (CID 140764521) is 2'-iminospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-4'-one.
What is the SMILES notation for 2'-iminospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-4'-one?
The canonical SMILES for 2'-iminospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-4'-one is [H]/N=C1\NC(=O)C2(CCc3ccccc32)O1.
What is the InChIKey of 2'-iminospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-4'-one?
The InChIKey is GSLXBWXDEDBPNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O2/c12-10-13-9(14)11(15-10)6-5-7-3-1-2-4-8(7)11/h1-4H,5-6H2,(H2,12,13,14).
What are the key properties of 2'-iminospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-4'-one?
2'-iminospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-4'-one has a molecular weight of 202.21 g/mol, XLogP of 0.91, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2'-iminospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-4'-one is sourced from PubChem (CID 140764521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).