1'-benzylspiro[2-benzofuran-3,4'-piperidine]-1-one

C19H19NO2 — CID 10266406

IUPAC1'-benzylspiro[2-benzofuran-3,4'-piperidine]-1-one
SMILESO=C1OC2(CCN(Cc3ccccc3)CC2)c2ccccc21
InChIInChI=1S/C19H19NO2/c21-18-16-8-4-5-9-17(16)19(22-18)10-12-20(13-11-19)14-15-6-2-1-3-7-15/h1-9H,10-14H2
InChIKeyRZXNEAPKBXXMQP-UHFFFAOYSA-N
MW293.37 g/mol
LogP3.35
Rot. Bonds2

About 1'-benzylspiro[2-benzofuran-3,4'-piperidine]-1-one

1'-benzylspiro[2-benzofuran-3,4'-piperidine]-1-one (PubChem CID 10266406) has the molecular formula C19H19NO2 and a molecular weight of 293.37 g/mol. Its IUPAC name is 1'-benzylspiro[2-benzofuran-3,4'-piperidine]-1-one.

Molecular Properties

Compound Name1'-benzylspiro[2-benzofuran-3,4'-piperidine]-1-one
PubChem CID10266406
Molecular FormulaC19H19NO2
Molecular Weight293.37 g/mol
Exact Mass293.14
IUPAC Name1'-benzylspiro[2-benzofuran-3,4'-piperidine]-1-one
SMILESO=C1OC2(CCN(Cc3ccccc3)CC2)c2ccccc21
InChIInChI=1S/C19H19NO2/c21-18-16-8-4-5-9-17(16)19(22-18)10-12-20(13-11-19)14-15-6-2-1-3-7-15/h1-9H,10-14H2
InChIKeyRZXNEAPKBXXMQP-UHFFFAOYSA-N
XLogP3.35
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1'-benzylspiro[2-benzofuran-3,4'-piperidine]-1-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'-benzylspiro[2-benzofuran-3,4'-piperidine]-1-one?
The IUPAC name of 1'-benzylspiro[2-benzofuran-3,4'-piperidine]-1-one (CID 10266406) is 1'-benzylspiro[2-benzofuran-3,4'-piperidine]-1-one.
What is the SMILES notation for 1'-benzylspiro[2-benzofuran-3,4'-piperidine]-1-one?
The canonical SMILES for 1'-benzylspiro[2-benzofuran-3,4'-piperidine]-1-one is O=C1OC2(CCN(Cc3ccccc3)CC2)c2ccccc21.
What is the InChIKey of 1'-benzylspiro[2-benzofuran-3,4'-piperidine]-1-one?
The InChIKey is RZXNEAPKBXXMQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19NO2/c21-18-16-8-4-5-9-17(16)19(22-18)10-12-20(13-11-19)14-15-6-2-1-3-7-15/h1-9H,10-14H2.
What are the key properties of 1'-benzylspiro[2-benzofuran-3,4'-piperidine]-1-one?
1'-benzylspiro[2-benzofuran-3,4'-piperidine]-1-one has a molecular weight of 293.37 g/mol, XLogP of 3.35, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1'-benzylspiro[2-benzofuran-3,4'-piperidine]-1-one is sourced from PubChem (CID 10266406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).