4-(furan-2-yl)-2-phenyl-1H-indole

C18H13NO — CID 53254141

IUPAC4-(furan-2-yl)-2-phenyl-1H-indole
SMILESc1ccc(-c2cc3c(-c4ccco4)cccc3[nH]2)cc1
InChIInChI=1S/C18H13NO/c1-2-6-13(7-3-1)17-12-15-14(18-10-5-11-20-18)8-4-9-16(15)19-17/h1-12,19H
InChIKeyHBVINJCHBIJSKB-UHFFFAOYSA-N
MW259.31 g/mol
LogP5.09
Rot. Bonds2

About 4-(furan-2-yl)-2-phenyl-1H-indole

4-(furan-2-yl)-2-phenyl-1H-indole (PubChem CID 53254141) has the molecular formula C18H13NO and a molecular weight of 259.31 g/mol. Its IUPAC name is 4-(furan-2-yl)-2-phenyl-1H-indole.

Molecular Properties

Compound Name4-(furan-2-yl)-2-phenyl-1H-indole
PubChem CID53254141
Molecular FormulaC18H13NO
Molecular Weight259.31 g/mol
Exact Mass259.10
IUPAC Name4-(furan-2-yl)-2-phenyl-1H-indole
SMILESc1ccc(-c2cc3c(-c4ccco4)cccc3[nH]2)cc1
InChIInChI=1S/C18H13NO/c1-2-6-13(7-3-1)17-12-15-14(18-10-5-11-20-18)8-4-9-16(15)19-17/h1-12,19H
InChIKeyHBVINJCHBIJSKB-UHFFFAOYSA-N
XLogP5.09
TPSA28.93 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500259.31
LogP ≤ 55.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-(furan-2-yl)-2-phenyl-1H-indole?
The IUPAC name of 4-(furan-2-yl)-2-phenyl-1H-indole (CID 53254141) is 4-(furan-2-yl)-2-phenyl-1H-indole.
What is the SMILES notation for 4-(furan-2-yl)-2-phenyl-1H-indole?
The canonical SMILES for 4-(furan-2-yl)-2-phenyl-1H-indole is c1ccc(-c2cc3c(-c4ccco4)cccc3[nH]2)cc1.
What is the InChIKey of 4-(furan-2-yl)-2-phenyl-1H-indole?
The InChIKey is HBVINJCHBIJSKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13NO/c1-2-6-13(7-3-1)17-12-15-14(18-10-5-11-20-18)8-4-9-16(15)19-17/h1-12,19H.
What are the key properties of 4-(furan-2-yl)-2-phenyl-1H-indole?
4-(furan-2-yl)-2-phenyl-1H-indole has a molecular weight of 259.31 g/mol, XLogP of 5.09, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(furan-2-yl)-2-phenyl-1H-indole is sourced from PubChem (CID 53254141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).