spiro[1,3-oxazolidine-2,1'-2H-naphthalene]-4-one

C12H11NO2 — CID 123743349

IUPACspiro[1,3-oxazolidine-2,1'-2H-naphthalene]-4-one
SMILESO=C1COC2(CC=Cc3ccccc32)N1
InChIInChI=1S/C12H11NO2/c14-11-8-15-12(13-11)7-3-5-9-4-1-2-6-10(9)12/h1-6H,7-8H2,(H,13,14)
InChIKeySOVWNDXIDXMIJG-UHFFFAOYSA-N
MW201.23 g/mol
LogP1.40
Rot. Bonds

About spiro[1,3-oxazolidine-2,1'-2H-naphthalene]-4-one

spiro[1,3-oxazolidine-2,1'-2H-naphthalene]-4-one (PubChem CID 123743349) has the molecular formula C12H11NO2 and a molecular weight of 201.23 g/mol. Its IUPAC name is spiro[1,3-oxazolidine-2,1'-2H-naphthalene]-4-one.

Molecular Properties

Compound Namespiro[1,3-oxazolidine-2,1'-2H-naphthalene]-4-one
PubChem CID123743349
Molecular FormulaC12H11NO2
Molecular Weight201.23 g/mol
Exact Mass201.08
IUPAC Namespiro[1,3-oxazolidine-2,1'-2H-naphthalene]-4-one
SMILESO=C1COC2(CC=Cc3ccccc32)N1
InChIInChI=1S/C12H11NO2/c14-11-8-15-12(13-11)7-3-5-9-4-1-2-6-10(9)12/h1-6H,7-8H2,(H,13,14)
InChIKeySOVWNDXIDXMIJG-UHFFFAOYSA-N
XLogP1.40
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.23
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of spiro[1,3-oxazolidine-2,1'-2H-naphthalene]-4-one?
The IUPAC name of spiro[1,3-oxazolidine-2,1'-2H-naphthalene]-4-one (CID 123743349) is spiro[1,3-oxazolidine-2,1'-2H-naphthalene]-4-one.
What is the SMILES notation for spiro[1,3-oxazolidine-2,1'-2H-naphthalene]-4-one?
The canonical SMILES for spiro[1,3-oxazolidine-2,1'-2H-naphthalene]-4-one is O=C1COC2(CC=Cc3ccccc32)N1.
What is the InChIKey of spiro[1,3-oxazolidine-2,1'-2H-naphthalene]-4-one?
The InChIKey is SOVWNDXIDXMIJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11NO2/c14-11-8-15-12(13-11)7-3-5-9-4-1-2-6-10(9)12/h1-6H,7-8H2,(H,13,14).
What are the key properties of spiro[1,3-oxazolidine-2,1'-2H-naphthalene]-4-one?
spiro[1,3-oxazolidine-2,1'-2H-naphthalene]-4-one has a molecular weight of 201.23 g/mol, XLogP of 1.40, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[1,3-oxazolidine-2,1'-2H-naphthalene]-4-one is sourced from PubChem (CID 123743349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).