1-bromo-2-fluoroindolizine

C8H5BrFN — CID 57486385

IUPAC1-bromo-2-fluoroindolizine
SMILESFc1cn2ccccc2c1Br
InChIInChI=1S/C8H5BrFN/c9-8-6(10)5-11-4-2-1-3-7(8)11/h1-5H
InChIKeyHLEQDEVTZJPLLC-UHFFFAOYSA-N
MW214.04 g/mol
LogP2.84
Rot. Bonds

About 1-bromo-2-fluoroindolizine

1-bromo-2-fluoroindolizine (PubChem CID 57486385) has the molecular formula C8H5BrFN and a molecular weight of 214.04 g/mol. Its IUPAC name is 1-bromo-2-fluoroindolizine.

Molecular Properties

Compound Name1-bromo-2-fluoroindolizine
PubChem CID57486385
Molecular FormulaC8H5BrFN
Molecular Weight214.04 g/mol
Exact Mass212.96
IUPAC Name1-bromo-2-fluoroindolizine
SMILESFc1cn2ccccc2c1Br
InChIInChI=1S/C8H5BrFN/c9-8-6(10)5-11-4-2-1-3-7(8)11/h1-5H
InChIKeyHLEQDEVTZJPLLC-UHFFFAOYSA-N
XLogP2.84
TPSA4.41 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.04
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1-bromo-2-fluoroindolizine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-bromo-2-fluoroindolizine?
The IUPAC name of 1-bromo-2-fluoroindolizine (CID 57486385) is 1-bromo-2-fluoroindolizine.
What is the SMILES notation for 1-bromo-2-fluoroindolizine?
The canonical SMILES for 1-bromo-2-fluoroindolizine is Fc1cn2ccccc2c1Br.
What is the InChIKey of 1-bromo-2-fluoroindolizine?
The InChIKey is HLEQDEVTZJPLLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5BrFN/c9-8-6(10)5-11-4-2-1-3-7(8)11/h1-5H.
What are the key properties of 1-bromo-2-fluoroindolizine?
1-bromo-2-fluoroindolizine has a molecular weight of 214.04 g/mol, XLogP of 2.84, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-2-fluoroindolizine is sourced from PubChem (CID 57486385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).