N-[2-(4-fluorophenoxy)phenyl]-2-imidazol-1-ylacetamide

C17H14FN3O2 — CID 46968168

IUPACN-[2-(4-fluorophenoxy)phenyl]-2-imidazol-1-ylacetamide
SMILESO=C(Cn1ccnc1)Nc1ccccc1Oc1ccc(F)cc1
InChIInChI=1S/C17H14FN3O2/c18-13-5-7-14(8-6-13)23-16-4-2-1-3-15(16)20-17(22)11-21-10-9-19-12-21/h1-10,12H,11H2,(H,20,22)
InChIKeyOWNHXOCGGPPIKN-UHFFFAOYSA-N
MW311.32 g/mol
LogP3.45
Rot. Bonds5

About N-[2-(4-fluorophenoxy)phenyl]-2-imidazol-1-ylacetamide

N-[2-(4-fluorophenoxy)phenyl]-2-imidazol-1-ylacetamide (PubChem CID 46968168) has the molecular formula C17H14FN3O2 and a molecular weight of 311.32 g/mol. Its IUPAC name is N-[2-(4-fluorophenoxy)phenyl]-2-imidazol-1-ylacetamide.

Molecular Properties

Compound NameN-[2-(4-fluorophenoxy)phenyl]-2-imidazol-1-ylacetamide
PubChem CID46968168
Molecular FormulaC17H14FN3O2
Molecular Weight311.32 g/mol
Exact Mass311.11
IUPAC NameN-[2-(4-fluorophenoxy)phenyl]-2-imidazol-1-ylacetamide
SMILESO=C(Cn1ccnc1)Nc1ccccc1Oc1ccc(F)cc1
InChIInChI=1S/C17H14FN3O2/c18-13-5-7-14(8-6-13)23-16-4-2-1-3-15(16)20-17(22)11-21-10-9-19-12-21/h1-10,12H,11H2,(H,20,22)
InChIKeyOWNHXOCGGPPIKN-UHFFFAOYSA-N
XLogP3.45
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.32
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(4-fluorophenoxy)phenyl]-2-imidazol-1-ylacetamide?
The IUPAC name of N-[2-(4-fluorophenoxy)phenyl]-2-imidazol-1-ylacetamide (CID 46968168) is N-[2-(4-fluorophenoxy)phenyl]-2-imidazol-1-ylacetamide.
What is the SMILES notation for N-[2-(4-fluorophenoxy)phenyl]-2-imidazol-1-ylacetamide?
The canonical SMILES for N-[2-(4-fluorophenoxy)phenyl]-2-imidazol-1-ylacetamide is O=C(Cn1ccnc1)Nc1ccccc1Oc1ccc(F)cc1.
What is the InChIKey of N-[2-(4-fluorophenoxy)phenyl]-2-imidazol-1-ylacetamide?
The InChIKey is OWNHXOCGGPPIKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FN3O2/c18-13-5-7-14(8-6-13)23-16-4-2-1-3-15(16)20-17(22)11-21-10-9-19-12-21/h1-10,12H,11H2,(H,20,22).
What are the key properties of N-[2-(4-fluorophenoxy)phenyl]-2-imidazol-1-ylacetamide?
N-[2-(4-fluorophenoxy)phenyl]-2-imidazol-1-ylacetamide has a molecular weight of 311.32 g/mol, XLogP of 3.45, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-fluorophenoxy)phenyl]-2-imidazol-1-ylacetamide is sourced from PubChem (CID 46968168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).