1-[5-(4-fluorophenoxy)pentyl]imidazole

C14H17FN2O — CID 2851826

IUPAC1-[5-(4-fluorophenoxy)pentyl]imidazole
SMILESFc1ccc(OCCCCCn2ccnc2)cc1
InChIInChI=1S/C14H17FN2O/c15-13-4-6-14(7-5-13)18-11-3-1-2-9-17-10-8-16-12-17/h4-8,10,12H,1-3,9,11H2
InChIKeyHRCADLUJXNOEPD-UHFFFAOYSA-N
MW248.30 g/mol
LogP3.27
Rot. Bonds7

About 1-[5-(4-fluorophenoxy)pentyl]imidazole

1-[5-(4-fluorophenoxy)pentyl]imidazole (PubChem CID 2851826) has the molecular formula C14H17FN2O and a molecular weight of 248.30 g/mol. Its IUPAC name is 1-[5-(4-fluorophenoxy)pentyl]imidazole.

Molecular Properties

Compound Name1-[5-(4-fluorophenoxy)pentyl]imidazole
PubChem CID2851826
Molecular FormulaC14H17FN2O
Molecular Weight248.30 g/mol
Exact Mass248.13
IUPAC Name1-[5-(4-fluorophenoxy)pentyl]imidazole
SMILESFc1ccc(OCCCCCn2ccnc2)cc1
InChIInChI=1S/C14H17FN2O/c15-13-4-6-14(7-5-13)18-11-3-1-2-9-17-10-8-16-12-17/h4-8,10,12H,1-3,9,11H2
InChIKeyHRCADLUJXNOEPD-UHFFFAOYSA-N
XLogP3.27
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.30
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 1-[5-(4-fluorophenoxy)pentyl]imidazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[4-(4-fluorophenoxy)butyl]imidazole
CID 31196577
1-[4-(4-chlorophenoxy)butyl]imidazole
CID 2843495
1-[6-(2,4-difluorophenoxy)hexyl]imidazole;hydrochloride
CID 19378837
1-[6-[4-(2-phenylethynyl)phenoxy]hexyl]imidazole
CID 101469157
1-[10-(4-nitrophenoxy)decyl]imidazole
CID 13219131
1-[4-(6-imidazol-1-ylhexoxy)phenyl]ethanol
CID 18921919
4-[[4-(8-imidazol-1-yloctoxy)phenyl]diazenyl]benzonitrile
CID 101189546
1-(4-fluorophenoxy)-N-(3-imidazol-1-ylpropyl)-2-methylpropan-2-amine
CID 18349625
1-[6-(3-methoxyphenoxy)hexyl]imidazole
CID 3758429
2-[4-(3-imidazol-1-ylpropoxy)phenyl]ethanol
CID 104601036
1-[4-(3-imidazol-1-ylpropoxy)phenyl]propan-2-one
CID 115495270
1-[2-(4-methoxyphenoxy)ethyl]imidazole
CID 868397

Frequently Asked Questions

What is the IUPAC name of 1-[5-(4-fluorophenoxy)pentyl]imidazole?
The IUPAC name of 1-[5-(4-fluorophenoxy)pentyl]imidazole (CID 2851826) is 1-[5-(4-fluorophenoxy)pentyl]imidazole.
What is the SMILES notation for 1-[5-(4-fluorophenoxy)pentyl]imidazole?
The canonical SMILES for 1-[5-(4-fluorophenoxy)pentyl]imidazole is Fc1ccc(OCCCCCn2ccnc2)cc1.
What is the InChIKey of 1-[5-(4-fluorophenoxy)pentyl]imidazole?
The InChIKey is HRCADLUJXNOEPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17FN2O/c15-13-4-6-14(7-5-13)18-11-3-1-2-9-17-10-8-16-12-17/h4-8,10,12H,1-3,9,11H2.
What are the key properties of 1-[5-(4-fluorophenoxy)pentyl]imidazole?
1-[5-(4-fluorophenoxy)pentyl]imidazole has a molecular weight of 248.30 g/mol, XLogP of 3.27, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(4-fluorophenoxy)pentyl]imidazole is sourced from PubChem (CID 2851826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).