1-bromo-2-(2-fluorophenyl)indole

C14H9BrFN — CID 67042478

IUPAC1-bromo-2-(2-fluorophenyl)indole
SMILESFc1ccccc1-c1cc2ccccc2n1Br
InChIInChI=1S/C14H9BrFN/c15-17-13-8-4-1-5-10(13)9-14(17)11-6-2-3-7-12(11)16/h1-9H
InChIKeyNLSVQKSGEAVUMM-UHFFFAOYSA-N
MW290.14 g/mol
LogP4.61
Rot. Bonds1

About 1-bromo-2-(2-fluorophenyl)indole

1-bromo-2-(2-fluorophenyl)indole (PubChem CID 67042478) has the molecular formula C14H9BrFN and a molecular weight of 290.14 g/mol. Its IUPAC name is 1-bromo-2-(2-fluorophenyl)indole.

Molecular Properties

Compound Name1-bromo-2-(2-fluorophenyl)indole
PubChem CID67042478
Molecular FormulaC14H9BrFN
Molecular Weight290.14 g/mol
Exact Mass288.99
IUPAC Name1-bromo-2-(2-fluorophenyl)indole
SMILESFc1ccccc1-c1cc2ccccc2n1Br
InChIInChI=1S/C14H9BrFN/c15-17-13-8-4-1-5-10(13)9-14(17)11-6-2-3-7-12(11)16/h1-9H
InChIKeyNLSVQKSGEAVUMM-UHFFFAOYSA-N
XLogP4.61
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.14
LogP ≤ 54.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-bromo-2-(2-fluorophenyl)indole?
The IUPAC name of 1-bromo-2-(2-fluorophenyl)indole (CID 67042478) is 1-bromo-2-(2-fluorophenyl)indole.
What is the SMILES notation for 1-bromo-2-(2-fluorophenyl)indole?
The canonical SMILES for 1-bromo-2-(2-fluorophenyl)indole is Fc1ccccc1-c1cc2ccccc2n1Br.
What is the InChIKey of 1-bromo-2-(2-fluorophenyl)indole?
The InChIKey is NLSVQKSGEAVUMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9BrFN/c15-17-13-8-4-1-5-10(13)9-14(17)11-6-2-3-7-12(11)16/h1-9H.
What are the key properties of 1-bromo-2-(2-fluorophenyl)indole?
1-bromo-2-(2-fluorophenyl)indole has a molecular weight of 290.14 g/mol, XLogP of 4.61, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-2-(2-fluorophenyl)indole is sourced from PubChem (CID 67042478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).