5-(5-bromo-2-fluorophenyl)-1-(4-methylphenyl)-4,5-dihydroimidazol-2-amine

C16H15BrFN3 — CID 79499023

IUPAC5-(5-bromo-2-fluorophenyl)-1-(4-methylphenyl)-4,5-dihydroimidazol-2-amine
SMILESCc1ccc(N2C(N)=NCC2c2cc(Br)ccc2F)cc1
InChIInChI=1S/C16H15BrFN3/c1-10-2-5-12(6-3-10)21-15(9-20-16(21)19)13-8-11(17)4-7-14(13)18/h2-8,15H,9H2,1H3,(H2,19,20)
InChIKeyLFZTUGRCLMYFCR-UHFFFAOYSA-N
MW348.22 g/mol
LogP3.77
Rot. Bonds2

About 5-(5-bromo-2-fluorophenyl)-1-(4-methylphenyl)-4,5-dihydroimidazol-2-amine

5-(5-bromo-2-fluorophenyl)-1-(4-methylphenyl)-4,5-dihydroimidazol-2-amine (PubChem CID 79499023) has the molecular formula C16H15BrFN3 and a molecular weight of 348.22 g/mol. Its IUPAC name is 5-(5-bromo-2-fluorophenyl)-1-(4-methylphenyl)-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound Name5-(5-bromo-2-fluorophenyl)-1-(4-methylphenyl)-4,5-dihydroimidazol-2-amine
PubChem CID79499023
Molecular FormulaC16H15BrFN3
Molecular Weight348.22 g/mol
Exact Mass347.04
IUPAC Name5-(5-bromo-2-fluorophenyl)-1-(4-methylphenyl)-4,5-dihydroimidazol-2-amine
SMILESCc1ccc(N2C(N)=NCC2c2cc(Br)ccc2F)cc1
InChIInChI=1S/C16H15BrFN3/c1-10-2-5-12(6-3-10)21-15(9-20-16(21)19)13-8-11(17)4-7-14(13)18/h2-8,15H,9H2,1H3,(H2,19,20)
InChIKeyLFZTUGRCLMYFCR-UHFFFAOYSA-N
XLogP3.77
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.22
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-(5-bromo-2-fluorophenyl)-1-(4-methylphenyl)-4,5-dihydroimidazol-2-amine 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 5-(5-bromo-2-fluorophenyl)-1-(4-methylphenyl)-4,5-dihydroimidazol-2-amine?
The IUPAC name of 5-(5-bromo-2-fluorophenyl)-1-(4-methylphenyl)-4,5-dihydroimidazol-2-amine (CID 79499023) is 5-(5-bromo-2-fluorophenyl)-1-(4-methylphenyl)-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for 5-(5-bromo-2-fluorophenyl)-1-(4-methylphenyl)-4,5-dihydroimidazol-2-amine?
The canonical SMILES for 5-(5-bromo-2-fluorophenyl)-1-(4-methylphenyl)-4,5-dihydroimidazol-2-amine is Cc1ccc(N2C(N)=NCC2c2cc(Br)ccc2F)cc1.
What is the InChIKey of 5-(5-bromo-2-fluorophenyl)-1-(4-methylphenyl)-4,5-dihydroimidazol-2-amine?
The InChIKey is LFZTUGRCLMYFCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15BrFN3/c1-10-2-5-12(6-3-10)21-15(9-20-16(21)19)13-8-11(17)4-7-14(13)18/h2-8,15H,9H2,1H3,(H2,19,20).
What are the key properties of 5-(5-bromo-2-fluorophenyl)-1-(4-methylphenyl)-4,5-dihydroimidazol-2-amine?
5-(5-bromo-2-fluorophenyl)-1-(4-methylphenyl)-4,5-dihydroimidazol-2-amine has a molecular weight of 348.22 g/mol, XLogP of 3.77, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-bromo-2-fluorophenyl)-1-(4-methylphenyl)-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 79499023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).