2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-1-(4-fluorophenyl)-4,5-dihydroimidazole

C18H17FN4 — CID 155567739

IUPAC2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-1-(4-fluorophenyl)-4,5-dihydroimidazole
SMILESFc1ccc(N2CCN=C2c2ccc(C3=NCCN3)cc2)cc1
InChIInChI=1S/C18H17FN4/c19-15-5-7-16(8-6-15)23-12-11-22-18(23)14-3-1-13(2-4-14)17-20-9-10-21-17/h1-8H,9-12H2,(H,20,21)
InChIKeyYOMUQESHEVPQPX-UHFFFAOYSA-N
MW308.36 g/mol
LogP2.44
Rot. Bonds3

About 2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-1-(4-fluorophenyl)-4,5-dihydroimidazole

2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-1-(4-fluorophenyl)-4,5-dihydroimidazole (PubChem CID 155567739) has the molecular formula C18H17FN4 and a molecular weight of 308.36 g/mol. Its IUPAC name is 2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-1-(4-fluorophenyl)-4,5-dihydroimidazole.

Molecular Properties

Compound Name2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-1-(4-fluorophenyl)-4,5-dihydroimidazole
PubChem CID155567739
Molecular FormulaC18H17FN4
Molecular Weight308.36 g/mol
Exact Mass308.14
IUPAC Name2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-1-(4-fluorophenyl)-4,5-dihydroimidazole
SMILESFc1ccc(N2CCN=C2c2ccc(C3=NCCN3)cc2)cc1
InChIInChI=1S/C18H17FN4/c19-15-5-7-16(8-6-15)23-12-11-22-18(23)14-3-1-13(2-4-14)17-20-9-10-21-17/h1-8H,9-12H2,(H,20,21)
InChIKeyYOMUQESHEVPQPX-UHFFFAOYSA-N
XLogP2.44
TPSA39.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.36
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-1-(4-fluorophenyl)-4,5-dihydroimidazole 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-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-1-(4-fluorophenyl)-4,5-dihydroimidazole?
The IUPAC name of 2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-1-(4-fluorophenyl)-4,5-dihydroimidazole (CID 155567739) is 2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-1-(4-fluorophenyl)-4,5-dihydroimidazole.
What is the SMILES notation for 2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-1-(4-fluorophenyl)-4,5-dihydroimidazole?
The canonical SMILES for 2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-1-(4-fluorophenyl)-4,5-dihydroimidazole is Fc1ccc(N2CCN=C2c2ccc(C3=NCCN3)cc2)cc1.
What is the InChIKey of 2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-1-(4-fluorophenyl)-4,5-dihydroimidazole?
The InChIKey is YOMUQESHEVPQPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17FN4/c19-15-5-7-16(8-6-15)23-12-11-22-18(23)14-3-1-13(2-4-14)17-20-9-10-21-17/h1-8H,9-12H2,(H,20,21).
What are the key properties of 2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-1-(4-fluorophenyl)-4,5-dihydroimidazole?
2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-1-(4-fluorophenyl)-4,5-dihydroimidazole has a molecular weight of 308.36 g/mol, XLogP of 2.44, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-1-(4-fluorophenyl)-4,5-dihydroimidazole is sourced from PubChem (CID 155567739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).