4-fluoro-1-(4-fluorophenyl)indole

C14H9F2N — CID 91138606

IUPAC4-fluoro-1-(4-fluorophenyl)indole
SMILESFc1ccc(-n2ccc3c(F)cccc32)cc1
InChIInChI=1S/C14H9F2N/c15-10-4-6-11(7-5-10)17-9-8-12-13(16)2-1-3-14(12)17/h1-9H
InChIKeyMVMOJKRITLHVPU-UHFFFAOYSA-N
MW229.23 g/mol
LogP3.91
Rot. Bonds1

About 4-fluoro-1-(4-fluorophenyl)indole

4-fluoro-1-(4-fluorophenyl)indole (PubChem CID 91138606) has the molecular formula C14H9F2N and a molecular weight of 229.23 g/mol. Its IUPAC name is 4-fluoro-1-(4-fluorophenyl)indole.

Molecular Properties

Compound Name4-fluoro-1-(4-fluorophenyl)indole
PubChem CID91138606
Molecular FormulaC14H9F2N
Molecular Weight229.23 g/mol
Exact Mass229.07
IUPAC Name4-fluoro-1-(4-fluorophenyl)indole
SMILESFc1ccc(-n2ccc3c(F)cccc32)cc1
InChIInChI=1S/C14H9F2N/c15-10-4-6-11(7-5-10)17-9-8-12-13(16)2-1-3-14(12)17/h1-9H
InChIKeyMVMOJKRITLHVPU-UHFFFAOYSA-N
XLogP3.91
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.23
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-1-(4-fluorophenyl)indole?
The IUPAC name of 4-fluoro-1-(4-fluorophenyl)indole (CID 91138606) is 4-fluoro-1-(4-fluorophenyl)indole.
What is the SMILES notation for 4-fluoro-1-(4-fluorophenyl)indole?
The canonical SMILES for 4-fluoro-1-(4-fluorophenyl)indole is Fc1ccc(-n2ccc3c(F)cccc32)cc1.
What is the InChIKey of 4-fluoro-1-(4-fluorophenyl)indole?
The InChIKey is MVMOJKRITLHVPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9F2N/c15-10-4-6-11(7-5-10)17-9-8-12-13(16)2-1-3-14(12)17/h1-9H.
What are the key properties of 4-fluoro-1-(4-fluorophenyl)indole?
4-fluoro-1-(4-fluorophenyl)indole has a molecular weight of 229.23 g/mol, XLogP of 3.91, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-1-(4-fluorophenyl)indole is sourced from PubChem (CID 91138606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).