spiro[2,4-dihydrochromene-3,5'-pyrrolidine]-2'-one

C12H13NO2 — CID 10560073

IUPACspiro[2,4-dihydrochromene-3,5'-pyrrolidine]-2'-one
SMILESO=C1CCC2(COc3ccccc3C2)N1
InChIInChI=1S/C12H13NO2/c14-11-5-6-12(13-11)7-9-3-1-2-4-10(9)15-8-12/h1-4H,5-8H2,(H,13,14)
InChIKeyUXGORTXJLZISLH-UHFFFAOYSA-N
MW203.24 g/mol
LogP1.27
Rot. Bonds

About spiro[2,4-dihydrochromene-3,5'-pyrrolidine]-2'-one

spiro[2,4-dihydrochromene-3,5'-pyrrolidine]-2'-one (PubChem CID 10560073) has the molecular formula C12H13NO2 and a molecular weight of 203.24 g/mol. Its IUPAC name is spiro[2,4-dihydrochromene-3,5'-pyrrolidine]-2'-one.

Molecular Properties

Compound Namespiro[2,4-dihydrochromene-3,5'-pyrrolidine]-2'-one
PubChem CID10560073
Molecular FormulaC12H13NO2
Molecular Weight203.24 g/mol
Exact Mass203.09
IUPAC Namespiro[2,4-dihydrochromene-3,5'-pyrrolidine]-2'-one
SMILESO=C1CCC2(COc3ccccc3C2)N1
InChIInChI=1S/C12H13NO2/c14-11-5-6-12(13-11)7-9-3-1-2-4-10(9)15-8-12/h1-4H,5-8H2,(H,13,14)
InChIKeyUXGORTXJLZISLH-UHFFFAOYSA-N
XLogP1.27
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of spiro[2,4-dihydrochromene-3,5'-pyrrolidine]-2'-one?
The IUPAC name of spiro[2,4-dihydrochromene-3,5'-pyrrolidine]-2'-one (CID 10560073) is spiro[2,4-dihydrochromene-3,5'-pyrrolidine]-2'-one.
What is the SMILES notation for spiro[2,4-dihydrochromene-3,5'-pyrrolidine]-2'-one?
The canonical SMILES for spiro[2,4-dihydrochromene-3,5'-pyrrolidine]-2'-one is O=C1CCC2(COc3ccccc3C2)N1.
What is the InChIKey of spiro[2,4-dihydrochromene-3,5'-pyrrolidine]-2'-one?
The InChIKey is UXGORTXJLZISLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO2/c14-11-5-6-12(13-11)7-9-3-1-2-4-10(9)15-8-12/h1-4H,5-8H2,(H,13,14).
What are the key properties of spiro[2,4-dihydrochromene-3,5'-pyrrolidine]-2'-one?
spiro[2,4-dihydrochromene-3,5'-pyrrolidine]-2'-one has a molecular weight of 203.24 g/mol, XLogP of 1.27, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[2,4-dihydrochromene-3,5'-pyrrolidine]-2'-one is sourced from PubChem (CID 10560073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).