2-[2-[2-(5-chloro-2-fluorophenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole

C17H16ClFN2 — CID 59715415

IUPAC2-[2-[2-(5-chloro-2-fluorophenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole
SMILESFc1ccc(Cl)cc1CCc1ccccc1C1=NCCN1
InChIInChI=1S/C17H16ClFN2/c18-14-7-8-16(19)13(11-14)6-5-12-3-1-2-4-15(12)17-20-9-10-21-17/h1-4,7-8,11H,5-6,9-10H2,(H,20,21)
InChIKeyHXYKIHLZTNUQMV-UHFFFAOYSA-N
MW302.78 g/mol
LogP3.61
Rot. Bonds4

About 2-[2-[2-(5-chloro-2-fluorophenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole

2-[2-[2-(5-chloro-2-fluorophenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole (PubChem CID 59715415) has the molecular formula C17H16ClFN2 and a molecular weight of 302.78 g/mol. Its IUPAC name is 2-[2-[2-(5-chloro-2-fluorophenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name2-[2-[2-(5-chloro-2-fluorophenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole
PubChem CID59715415
Molecular FormulaC17H16ClFN2
Molecular Weight302.78 g/mol
Exact Mass302.10
IUPAC Name2-[2-[2-(5-chloro-2-fluorophenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole
SMILESFc1ccc(Cl)cc1CCc1ccccc1C1=NCCN1
InChIInChI=1S/C17H16ClFN2/c18-14-7-8-16(19)13(11-14)6-5-12-3-1-2-4-15(12)17-20-9-10-21-17/h1-4,7-8,11H,5-6,9-10H2,(H,20,21)
InChIKeyHXYKIHLZTNUQMV-UHFFFAOYSA-N
XLogP3.61
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.78
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[2-[2-(5-chloro-2-fluorophenyl)ethyl]phenyl]-4,5-dihydro-1H-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-[2-[2-(5-chloro-2-fluorophenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole?
The IUPAC name of 2-[2-[2-(5-chloro-2-fluorophenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole (CID 59715415) is 2-[2-[2-(5-chloro-2-fluorophenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole.
What is the SMILES notation for 2-[2-[2-(5-chloro-2-fluorophenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole?
The canonical SMILES for 2-[2-[2-(5-chloro-2-fluorophenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole is Fc1ccc(Cl)cc1CCc1ccccc1C1=NCCN1.
What is the InChIKey of 2-[2-[2-(5-chloro-2-fluorophenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole?
The InChIKey is HXYKIHLZTNUQMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16ClFN2/c18-14-7-8-16(19)13(11-14)6-5-12-3-1-2-4-15(12)17-20-9-10-21-17/h1-4,7-8,11H,5-6,9-10H2,(H,20,21).
What are the key properties of 2-[2-[2-(5-chloro-2-fluorophenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole?
2-[2-[2-(5-chloro-2-fluorophenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole has a molecular weight of 302.78 g/mol, XLogP of 3.61, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-(5-chloro-2-fluorophenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 59715415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).