2-(4-chlorophenyl)-5-(2-fluoroethyl)-4-phenyl-1H-imidazole

C17H14ClFN2 — CID 13470701

IUPAC2-(4-chlorophenyl)-5-(2-fluoroethyl)-4-phenyl-1H-imidazole
SMILESFCCc1[nH]c(-c2ccc(Cl)cc2)nc1-c1ccccc1
InChIInChI=1S/C17H14ClFN2/c18-14-8-6-13(7-9-14)17-20-15(10-11-19)16(21-17)12-4-2-1-3-5-12/h1-9H,10-11H2,(H,20,21)
InChIKeyARBXNLRALFXYLW-UHFFFAOYSA-N
MW300.76 g/mol
LogP4.91
Rot. Bonds4

About 2-(4-chlorophenyl)-5-(2-fluoroethyl)-4-phenyl-1H-imidazole

2-(4-chlorophenyl)-5-(2-fluoroethyl)-4-phenyl-1H-imidazole (PubChem CID 13470701) has the molecular formula C17H14ClFN2 and a molecular weight of 300.76 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-5-(2-fluoroethyl)-4-phenyl-1H-imidazole.

Molecular Properties

Compound Name2-(4-chlorophenyl)-5-(2-fluoroethyl)-4-phenyl-1H-imidazole
PubChem CID13470701
Molecular FormulaC17H14ClFN2
Molecular Weight300.76 g/mol
Exact Mass300.08
IUPAC Name2-(4-chlorophenyl)-5-(2-fluoroethyl)-4-phenyl-1H-imidazole
SMILESFCCc1[nH]c(-c2ccc(Cl)cc2)nc1-c1ccccc1
InChIInChI=1S/C17H14ClFN2/c18-14-8-6-13(7-9-14)17-20-15(10-11-19)16(21-17)12-4-2-1-3-5-12/h1-9H,10-11H2,(H,20,21)
InChIKeyARBXNLRALFXYLW-UHFFFAOYSA-N
XLogP4.91
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.76
LogP ≤ 54.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-5-(2-fluoroethyl)-4-phenyl-1H-imidazole?
The IUPAC name of 2-(4-chlorophenyl)-5-(2-fluoroethyl)-4-phenyl-1H-imidazole (CID 13470701) is 2-(4-chlorophenyl)-5-(2-fluoroethyl)-4-phenyl-1H-imidazole.
What is the SMILES notation for 2-(4-chlorophenyl)-5-(2-fluoroethyl)-4-phenyl-1H-imidazole?
The canonical SMILES for 2-(4-chlorophenyl)-5-(2-fluoroethyl)-4-phenyl-1H-imidazole is FCCc1[nH]c(-c2ccc(Cl)cc2)nc1-c1ccccc1.
What is the InChIKey of 2-(4-chlorophenyl)-5-(2-fluoroethyl)-4-phenyl-1H-imidazole?
The InChIKey is ARBXNLRALFXYLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14ClFN2/c18-14-8-6-13(7-9-14)17-20-15(10-11-19)16(21-17)12-4-2-1-3-5-12/h1-9H,10-11H2,(H,20,21).
What are the key properties of 2-(4-chlorophenyl)-5-(2-fluoroethyl)-4-phenyl-1H-imidazole?
2-(4-chlorophenyl)-5-(2-fluoroethyl)-4-phenyl-1H-imidazole has a molecular weight of 300.76 g/mol, XLogP of 4.91, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-5-(2-fluoroethyl)-4-phenyl-1H-imidazole is sourced from PubChem (CID 13470701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).