2,4-dibromo-1-(2-fluoroethyl)imidazole

C5H5Br2FN2 — CID 134515780

IUPAC2,4-dibromo-1-(2-fluoroethyl)imidazole
SMILESFCCn1cc(Br)nc1Br
InChIInChI=1S/C5H5Br2FN2/c6-4-3-10(2-1-8)5(7)9-4/h3H,1-2H2
InChIKeyTWOWJZYAXKTNDR-UHFFFAOYSA-N
MW271.92 g/mol
LogP2.38
Rot. Bonds2

About 2,4-dibromo-1-(2-fluoroethyl)imidazole

2,4-dibromo-1-(2-fluoroethyl)imidazole (PubChem CID 134515780) has the molecular formula C5H5Br2FN2 and a molecular weight of 271.92 g/mol. Its IUPAC name is 2,4-dibromo-1-(2-fluoroethyl)imidazole.

Molecular Properties

Compound Name2,4-dibromo-1-(2-fluoroethyl)imidazole
PubChem CID134515780
Molecular FormulaC5H5Br2FN2
Molecular Weight271.92 g/mol
Exact Mass269.88
IUPAC Name2,4-dibromo-1-(2-fluoroethyl)imidazole
SMILESFCCn1cc(Br)nc1Br
InChIInChI=1S/C5H5Br2FN2/c6-4-3-10(2-1-8)5(7)9-4/h3H,1-2H2
InChIKeyTWOWJZYAXKTNDR-UHFFFAOYSA-N
XLogP2.38
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.92
LogP ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2,4-dibromo-1-(2-fluoroethyl)imidazole 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 2,4-dibromo-1-(2-fluoroethyl)imidazole?
The IUPAC name of 2,4-dibromo-1-(2-fluoroethyl)imidazole (CID 134515780) is 2,4-dibromo-1-(2-fluoroethyl)imidazole.
What is the SMILES notation for 2,4-dibromo-1-(2-fluoroethyl)imidazole?
The canonical SMILES for 2,4-dibromo-1-(2-fluoroethyl)imidazole is FCCn1cc(Br)nc1Br.
What is the InChIKey of 2,4-dibromo-1-(2-fluoroethyl)imidazole?
The InChIKey is TWOWJZYAXKTNDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5Br2FN2/c6-4-3-10(2-1-8)5(7)9-4/h3H,1-2H2.
What are the key properties of 2,4-dibromo-1-(2-fluoroethyl)imidazole?
2,4-dibromo-1-(2-fluoroethyl)imidazole has a molecular weight of 271.92 g/mol, XLogP of 2.38, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dibromo-1-(2-fluoroethyl)imidazole is sourced from PubChem (CID 134515780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).