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

C11H10N2O2 — CID 140755972

IUPAC2'-iminospiro[1,3-dihydroindene-2,5'-1,3-oxazolidine]-4'-one
SMILES[H]/N=C1/NC(=O)C2(Cc3ccccc3C2)O1
InChIInChI=1S/C11H10N2O2/c12-10-13-9(14)11(15-10)5-7-3-1-2-4-8(7)6-11/h1-4H,5-6H2,(H2,12,13,14)
InChIKeyIGRWRHOTSCTCJY-UHFFFAOYSA-N
MW202.21 g/mol
LogP0.61
Rot. Bonds

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

2'-iminospiro[1,3-dihydroindene-2,5'-1,3-oxazolidine]-4'-one (PubChem CID 140755972) has the molecular formula C11H10N2O2 and a molecular weight of 202.21 g/mol. Its IUPAC name is 2'-iminospiro[1,3-dihydroindene-2,5'-1,3-oxazolidine]-4'-one.

Molecular Properties

Compound Name2'-iminospiro[1,3-dihydroindene-2,5'-1,3-oxazolidine]-4'-one
PubChem CID140755972
Molecular FormulaC11H10N2O2
Molecular Weight202.21 g/mol
Exact Mass202.07
IUPAC Name2'-iminospiro[1,3-dihydroindene-2,5'-1,3-oxazolidine]-4'-one
SMILES[H]/N=C1/NC(=O)C2(Cc3ccccc3C2)O1
InChIInChI=1S/C11H10N2O2/c12-10-13-9(14)11(15-10)5-7-3-1-2-4-8(7)6-11/h1-4H,5-6H2,(H2,12,13,14)
InChIKeyIGRWRHOTSCTCJY-UHFFFAOYSA-N
XLogP0.61
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 ≤ 50.61
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

2'-iminospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-4'-one
CID 140764521
3-imino-4H-isoquinolin-1-one
CID 152765560
spiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-2',4'-dione
CID 13053011
(5R)-4-iminospiro[1,3-oxazolidine-5,4'-2,3-dihydro-1H-naphthalene]-2-one
CID 164631160
2'-aminospiro[1,3-dihydroindene-2,4'-1H-imidazole]-5'-one
CID 10856526
3-imino-1H-inden-2-one
CID 142098046
spiro[1,3-dihydroindene-2,4'-isoquinoline]-1',3'-dione
CID 44725575
1-sulfanylidene-4H-isoquinolin-3-one
CID 2752457
spiro[1H-indole-3,2'-3,4-dihydrochromene]-2-one
CID 166063555
1,3-dihydroindol-2-one;trihydrochloride
CID 66960013
6'-bromospiro[1,3-dihydroindene-2,2'-3H-chromene]-4'-one
CID 58423986
5-(2,2-dimethyl-3H-1-benzofuran-7-yl)-4-imino-1-propylimidazolidin-2-one
CID 138388646

Frequently Asked Questions

What is the IUPAC name of 2'-iminospiro[1,3-dihydroindene-2,5'-1,3-oxazolidine]-4'-one?
The IUPAC name of 2'-iminospiro[1,3-dihydroindene-2,5'-1,3-oxazolidine]-4'-one (CID 140755972) is 2'-iminospiro[1,3-dihydroindene-2,5'-1,3-oxazolidine]-4'-one.
What is the SMILES notation for 2'-iminospiro[1,3-dihydroindene-2,5'-1,3-oxazolidine]-4'-one?
The canonical SMILES for 2'-iminospiro[1,3-dihydroindene-2,5'-1,3-oxazolidine]-4'-one is [H]/N=C1/NC(=O)C2(Cc3ccccc3C2)O1.
What is the InChIKey of 2'-iminospiro[1,3-dihydroindene-2,5'-1,3-oxazolidine]-4'-one?
The InChIKey is IGRWRHOTSCTCJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O2/c12-10-13-9(14)11(15-10)5-7-3-1-2-4-8(7)6-11/h1-4H,5-6H2,(H2,12,13,14).
What are the key properties of 2'-iminospiro[1,3-dihydroindene-2,5'-1,3-oxazolidine]-4'-one?
2'-iminospiro[1,3-dihydroindene-2,5'-1,3-oxazolidine]-4'-one has a molecular weight of 202.21 g/mol, XLogP of 0.61, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2'-iminospiro[1,3-dihydroindene-2,5'-1,3-oxazolidine]-4'-one is sourced from PubChem (CID 140755972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).