1'-methylspiro[2H-1-benzofuran-3,4'-imidazolidine]-2'-one

C11H12N2O2 — CID 175868133

IUPAC1'-methylspiro[2H-1-benzofuran-3,4'-imidazolidine]-2'-one
SMILESCN1CC2(COc3ccccc32)NC1=O
InChIInChI=1S/C11H12N2O2/c1-13-6-11(12-10(13)14)7-15-9-5-3-2-4-8(9)11/h2-5H,6-7H2,1H3,(H,12,14)
InChIKeyYIONOPVNVRPLIQ-UHFFFAOYSA-N
MW204.23 g/mol
LogP0.93
Rot. Bonds

About 1'-methylspiro[2H-1-benzofuran-3,4'-imidazolidine]-2'-one

1'-methylspiro[2H-1-benzofuran-3,4'-imidazolidine]-2'-one (PubChem CID 175868133) has the molecular formula C11H12N2O2 and a molecular weight of 204.23 g/mol. Its IUPAC name is 1'-methylspiro[2H-1-benzofuran-3,4'-imidazolidine]-2'-one.

Molecular Properties

Compound Name1'-methylspiro[2H-1-benzofuran-3,4'-imidazolidine]-2'-one
PubChem CID175868133
Molecular FormulaC11H12N2O2
Molecular Weight204.23 g/mol
Exact Mass204.09
IUPAC Name1'-methylspiro[2H-1-benzofuran-3,4'-imidazolidine]-2'-one
SMILESCN1CC2(COc3ccccc32)NC1=O
InChIInChI=1S/C11H12N2O2/c1-13-6-11(12-10(13)14)7-15-9-5-3-2-4-8(9)11/h2-5H,6-7H2,1H3,(H,12,14)
InChIKeyYIONOPVNVRPLIQ-UHFFFAOYSA-N
XLogP0.93
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1'-methylspiro[2H-1-benzofuran-3,4'-imidazolidine]-2'-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1'-methylspiro[2H-1-benzofuran-3,4'-imidazolidine]-2'-one?
The IUPAC name of 1'-methylspiro[2H-1-benzofuran-3,4'-imidazolidine]-2'-one (CID 175868133) is 1'-methylspiro[2H-1-benzofuran-3,4'-imidazolidine]-2'-one.
What is the SMILES notation for 1'-methylspiro[2H-1-benzofuran-3,4'-imidazolidine]-2'-one?
The canonical SMILES for 1'-methylspiro[2H-1-benzofuran-3,4'-imidazolidine]-2'-one is CN1CC2(COc3ccccc32)NC1=O.
What is the InChIKey of 1'-methylspiro[2H-1-benzofuran-3,4'-imidazolidine]-2'-one?
The InChIKey is YIONOPVNVRPLIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2/c1-13-6-11(12-10(13)14)7-15-9-5-3-2-4-8(9)11/h2-5H,6-7H2,1H3,(H,12,14).
What are the key properties of 1'-methylspiro[2H-1-benzofuran-3,4'-imidazolidine]-2'-one?
1'-methylspiro[2H-1-benzofuran-3,4'-imidazolidine]-2'-one has a molecular weight of 204.23 g/mol, XLogP of 0.93, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1'-methylspiro[2H-1-benzofuran-3,4'-imidazolidine]-2'-one is sourced from PubChem (CID 175868133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).