3-dibenzofuran-4-yl-1H-indole

C20H13NO — CID 91231611

IUPAC3-dibenzofuran-4-yl-1H-indole
SMILESc1ccc2c(-c3cccc4c3oc3ccccc34)c[nH]c2c1
InChIInChI=1S/C20H13NO/c1-3-10-18-13(6-1)17(12-21-18)16-9-5-8-15-14-7-2-4-11-19(14)22-20(15)16/h1-12,21H
InChIKeyLLBWASNHEYMURY-UHFFFAOYSA-N
MW283.33 g/mol
LogP5.73
Rot. Bonds1

About 3-dibenzofuran-4-yl-1H-indole

3-dibenzofuran-4-yl-1H-indole (PubChem CID 91231611) has the molecular formula C20H13NO and a molecular weight of 283.33 g/mol. Its IUPAC name is 3-dibenzofuran-4-yl-1H-indole.

Molecular Properties

Compound Name3-dibenzofuran-4-yl-1H-indole
PubChem CID91231611
Molecular FormulaC20H13NO
Molecular Weight283.33 g/mol
Exact Mass283.10
IUPAC Name3-dibenzofuran-4-yl-1H-indole
SMILESc1ccc2c(-c3cccc4c3oc3ccccc34)c[nH]c2c1
InChIInChI=1S/C20H13NO/c1-3-10-18-13(6-1)17(12-21-18)16-9-5-8-15-14-7-2-4-11-19(14)22-20(15)16/h1-12,21H
InChIKeyLLBWASNHEYMURY-UHFFFAOYSA-N
XLogP5.73
TPSA28.93 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500283.33
LogP ≤ 55.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-dibenzofuran-4-yl-1H-indole?
The IUPAC name of 3-dibenzofuran-4-yl-1H-indole (CID 91231611) is 3-dibenzofuran-4-yl-1H-indole.
What is the SMILES notation for 3-dibenzofuran-4-yl-1H-indole?
The canonical SMILES for 3-dibenzofuran-4-yl-1H-indole is c1ccc2c(-c3cccc4c3oc3ccccc34)c[nH]c2c1.
What is the InChIKey of 3-dibenzofuran-4-yl-1H-indole?
The InChIKey is LLBWASNHEYMURY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H13NO/c1-3-10-18-13(6-1)17(12-21-18)16-9-5-8-15-14-7-2-4-11-19(14)22-20(15)16/h1-12,21H.
What are the key properties of 3-dibenzofuran-4-yl-1H-indole?
3-dibenzofuran-4-yl-1H-indole has a molecular weight of 283.33 g/mol, XLogP of 5.73, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-dibenzofuran-4-yl-1H-indole is sourced from PubChem (CID 91231611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).