1-benzyl-3-(furan-2-yl)indole

C19H15NO — CID 69416444

IUPAC1-benzyl-3-(furan-2-yl)indole
SMILESc1ccc(Cn2cc(-c3ccco3)c3ccccc32)cc1
InChIInChI=1S/C19H15NO/c1-2-7-15(8-3-1)13-20-14-17(19-11-6-12-21-19)16-9-4-5-10-18(16)20/h1-12,14H,13H2
InChIKeyUKGXQESRRTXSAC-UHFFFAOYSA-N
MW273.34 g/mol
LogP4.95
Rot. Bonds3

About 1-benzyl-3-(furan-2-yl)indole

1-benzyl-3-(furan-2-yl)indole (PubChem CID 69416444) has the molecular formula C19H15NO and a molecular weight of 273.34 g/mol. Its IUPAC name is 1-benzyl-3-(furan-2-yl)indole.

Molecular Properties

Compound Name1-benzyl-3-(furan-2-yl)indole
PubChem CID69416444
Molecular FormulaC19H15NO
Molecular Weight273.34 g/mol
Exact Mass273.12
IUPAC Name1-benzyl-3-(furan-2-yl)indole
SMILESc1ccc(Cn2cc(-c3ccco3)c3ccccc32)cc1
InChIInChI=1S/C19H15NO/c1-2-7-15(8-3-1)13-20-14-17(19-11-6-12-21-19)16-9-4-5-10-18(16)20/h1-12,14H,13H2
InChIKeyUKGXQESRRTXSAC-UHFFFAOYSA-N
XLogP4.95
TPSA18.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 54.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-benzyl-3-(furan-2-yl)indole?
The IUPAC name of 1-benzyl-3-(furan-2-yl)indole (CID 69416444) is 1-benzyl-3-(furan-2-yl)indole.
What is the SMILES notation for 1-benzyl-3-(furan-2-yl)indole?
The canonical SMILES for 1-benzyl-3-(furan-2-yl)indole is c1ccc(Cn2cc(-c3ccco3)c3ccccc32)cc1.
What is the InChIKey of 1-benzyl-3-(furan-2-yl)indole?
The InChIKey is UKGXQESRRTXSAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15NO/c1-2-7-15(8-3-1)13-20-14-17(19-11-6-12-21-19)16-9-4-5-10-18(16)20/h1-12,14H,13H2.
What are the key properties of 1-benzyl-3-(furan-2-yl)indole?
1-benzyl-3-(furan-2-yl)indole has a molecular weight of 273.34 g/mol, XLogP of 4.95, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-3-(furan-2-yl)indole is sourced from PubChem (CID 69416444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).