3-(1-benzofuran-2-yl)-1-benzylindole

Name: 3-(1-benzofuran-2-yl)-1-benzylindole — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₂₃H₁₇NO — CID 135058833

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC3-(1-benzofuran-2-yl)-1-benzylindole

SMILESc1ccc(Cn2cc(-c3cc4ccccc4o3)c3ccccc32)cc1

InChIInChI=1S/C23H17NO/c1-2-8-17(9-3-1)15-24-16-20(19-11-5-6-12-21(19)24)23-14-18-10-4-7-13-22(18)25-23/h1-14,16H,15H2

InChIKeyWLISPCDLVGRASO-UHFFFAOYSA-N

MW323.40 g/mol

LogP6.10

Rot. Bonds3

About 3-(1-benzofuran-2-yl)-1-benzylindole

3-(1-benzofuran-2-yl)-1-benzylindole (PubChem CID 135058833) has the molecular formula C₂₃H₁₇NO and a molecular weight of 323.40 g/mol. Its IUPAC name is 3-(1-benzofuran-2-yl)-1-benzylindole.

Molecular Properties

Compound Name	3-(1-benzofuran-2-yl)-1-benzylindole
PubChem CID	135058833
Molecular Formula	C₂₃H₁₇NO
Molecular Weight	323.40 g/mol
Exact Mass	323.13
IUPAC Name	3-(1-benzofuran-2-yl)-1-benzylindole
SMILES	c1ccc(Cn2cc(-c3cc4ccccc4o3)c3ccccc32)cc1
InChI	InChI=1S/C23H17NO/c1-2-8-17(9-3-1)15-24-16-20(19-11-5-6-12-21(19)24)23-14-18-10-4-7-13-22(18)25-23/h1-14,16H,15H2
InChIKey	WLISPCDLVGRASO-UHFFFAOYSA-N
XLogP	6.10
TPSA	18.07 Å²
H-Bond Donors
H-Bond Acceptors	2
Rotatable Bonds	3
Heavy Atoms	25
Complexity	—

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	323.40
LogP ≤ 5	6.10
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Frequently Asked Questions

What is the IUPAC name of 3-(1-benzofuran-2-yl)-1-benzylindole?

The IUPAC name of 3-(1-benzofuran-2-yl)-1-benzylindole (CID 135058833) is 3-(1-benzofuran-2-yl)-1-benzylindole.

What is the SMILES notation for 3-(1-benzofuran-2-yl)-1-benzylindole?

The canonical SMILES for 3-(1-benzofuran-2-yl)-1-benzylindole is c1ccc(Cn2cc(-c3cc4ccccc4o3)c3ccccc32)cc1.

What is the InChIKey of 3-(1-benzofuran-2-yl)-1-benzylindole?

The InChIKey is WLISPCDLVGRASO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17NO/c1-2-8-17(9-3-1)15-24-16-20(19-11-5-6-12-21(19)24)23-14-18-10-4-7-13-22(18)25-23/h1-14,16H,15H2.

What are the key properties of 3-(1-benzofuran-2-yl)-1-benzylindole?

3-(1-benzofuran-2-yl)-1-benzylindole has a molecular weight of 323.40 g/mol, XLogP of 6.10, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 3-(1-benzofuran-2-yl)-1-benzylindole is sourced from PubChem (CID 135058833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 135058833 — identifiers, structure, computed properties (public domain)

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