(3,5-dimethyl-2,3-dihydro-1H-indol-2-yl)-spiro[2H-1-benzofuran-3,4'-piperidine]-1'-ylmethanone

C23H26N2O2 — CID 70879126

IUPAC(3,5-dimethyl-2,3-dihydro-1H-indol-2-yl)-spiro[2H-1-benzofuran-3,4'-piperidine]-1'-ylmethanone
SMILESCc1ccc2c(c1)C(C)C(C(=O)N1CCC3(CC1)COc1ccccc13)N2
InChIInChI=1S/C23H26N2O2/c1-15-7-8-19-17(13-15)16(2)21(24-19)22(26)25-11-9-23(10-12-25)14-27-20-6-4-3-5-18(20)23/h3-8,13,16,21,24H,9-12,14H2,1-2H3
InChIKeyGOJRDZUVKCPXAB-UHFFFAOYSA-N
MW362.47 g/mol
LogP3.85
Rot. Bonds1

About (3,5-dimethyl-2,3-dihydro-1H-indol-2-yl)-spiro[2H-1-benzofuran-3,4'-piperidine]-1'-ylmethanone

(3,5-dimethyl-2,3-dihydro-1H-indol-2-yl)-spiro[2H-1-benzofuran-3,4'-piperidine]-1'-ylmethanone (PubChem CID 70879126) has the molecular formula C23H26N2O2 and a molecular weight of 362.47 g/mol. Its IUPAC name is (3,5-dimethyl-2,3-dihydro-1H-indol-2-yl)-spiro[2H-1-benzofuran-3,4'-piperidine]-1'-ylmethanone.

Molecular Properties

Compound Name(3,5-dimethyl-2,3-dihydro-1H-indol-2-yl)-spiro[2H-1-benzofuran-3,4'-piperidine]-1'-ylmethanone
PubChem CID70879126
Molecular FormulaC23H26N2O2
Molecular Weight362.47 g/mol
Exact Mass362.20
IUPAC Name(3,5-dimethyl-2,3-dihydro-1H-indol-2-yl)-spiro[2H-1-benzofuran-3,4'-piperidine]-1'-ylmethanone
SMILESCc1ccc2c(c1)C(C)C(C(=O)N1CCC3(CC1)COc1ccccc13)N2
InChIInChI=1S/C23H26N2O2/c1-15-7-8-19-17(13-15)16(2)21(24-19)22(26)25-11-9-23(10-12-25)14-27-20-6-4-3-5-18(20)23/h3-8,13,16,21,24H,9-12,14H2,1-2H3
InChIKeyGOJRDZUVKCPXAB-UHFFFAOYSA-N
XLogP3.85
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.47
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (3,5-dimethyl-2,3-dihydro-1H-indol-2-yl)-spiro[2H-1-benzofuran-3,4'-piperidine]-1'-ylmethanone 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 (3,5-dimethyl-2,3-dihydro-1H-indol-2-yl)-spiro[2H-1-benzofuran-3,4'-piperidine]-1'-ylmethanone?
The IUPAC name of (3,5-dimethyl-2,3-dihydro-1H-indol-2-yl)-spiro[2H-1-benzofuran-3,4'-piperidine]-1'-ylmethanone (CID 70879126) is (3,5-dimethyl-2,3-dihydro-1H-indol-2-yl)-spiro[2H-1-benzofuran-3,4'-piperidine]-1'-ylmethanone.
What is the SMILES notation for (3,5-dimethyl-2,3-dihydro-1H-indol-2-yl)-spiro[2H-1-benzofuran-3,4'-piperidine]-1'-ylmethanone?
The canonical SMILES for (3,5-dimethyl-2,3-dihydro-1H-indol-2-yl)-spiro[2H-1-benzofuran-3,4'-piperidine]-1'-ylmethanone is Cc1ccc2c(c1)C(C)C(C(=O)N1CCC3(CC1)COc1ccccc13)N2.
What is the InChIKey of (3,5-dimethyl-2,3-dihydro-1H-indol-2-yl)-spiro[2H-1-benzofuran-3,4'-piperidine]-1'-ylmethanone?
The InChIKey is GOJRDZUVKCPXAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N2O2/c1-15-7-8-19-17(13-15)16(2)21(24-19)22(26)25-11-9-23(10-12-25)14-27-20-6-4-3-5-18(20)23/h3-8,13,16,21,24H,9-12,14H2,1-2H3.
What are the key properties of (3,5-dimethyl-2,3-dihydro-1H-indol-2-yl)-spiro[2H-1-benzofuran-3,4'-piperidine]-1'-ylmethanone?
(3,5-dimethyl-2,3-dihydro-1H-indol-2-yl)-spiro[2H-1-benzofuran-3,4'-piperidine]-1'-ylmethanone has a molecular weight of 362.47 g/mol, XLogP of 3.85, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dimethyl-2,3-dihydro-1H-indol-2-yl)-spiro[2H-1-benzofuran-3,4'-piperidine]-1'-ylmethanone is sourced from PubChem (CID 70879126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).