4-fluoro-1-(2-methoxyethyl)imidazole

C6H9FN2O — CID 170388204

IUPAC4-fluoro-1-(2-methoxyethyl)imidazole
SMILESCOCCn1cnc(F)c1
InChIInChI=1S/C6H9FN2O/c1-10-3-2-9-4-6(7)8-5-9/h4-5H,2-3H2,1H3
InChIKeyLWOKIFMQGYHFJR-UHFFFAOYSA-N
MW144.15 g/mol
LogP0.67
Rot. Bonds3

About 4-fluoro-1-(2-methoxyethyl)imidazole

4-fluoro-1-(2-methoxyethyl)imidazole (PubChem CID 170388204) has the molecular formula C6H9FN2O and a molecular weight of 144.15 g/mol. Its IUPAC name is 4-fluoro-1-(2-methoxyethyl)imidazole.

Molecular Properties

Compound Name4-fluoro-1-(2-methoxyethyl)imidazole
PubChem CID170388204
Molecular FormulaC6H9FN2O
Molecular Weight144.15 g/mol
Exact Mass144.07
IUPAC Name4-fluoro-1-(2-methoxyethyl)imidazole
SMILESCOCCn1cnc(F)c1
InChIInChI=1S/C6H9FN2O/c1-10-3-2-9-4-6(7)8-5-9/h4-5H,2-3H2,1H3
InChIKeyLWOKIFMQGYHFJR-UHFFFAOYSA-N
XLogP0.67
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.15
LogP ≤ 50.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-fluoro-1-(2-methoxyethyl)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 4-fluoro-1-(2-methoxyethyl)imidazole?
The IUPAC name of 4-fluoro-1-(2-methoxyethyl)imidazole (CID 170388204) is 4-fluoro-1-(2-methoxyethyl)imidazole.
What is the SMILES notation for 4-fluoro-1-(2-methoxyethyl)imidazole?
The canonical SMILES for 4-fluoro-1-(2-methoxyethyl)imidazole is COCCn1cnc(F)c1.
What is the InChIKey of 4-fluoro-1-(2-methoxyethyl)imidazole?
The InChIKey is LWOKIFMQGYHFJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9FN2O/c1-10-3-2-9-4-6(7)8-5-9/h4-5H,2-3H2,1H3.
What are the key properties of 4-fluoro-1-(2-methoxyethyl)imidazole?
4-fluoro-1-(2-methoxyethyl)imidazole has a molecular weight of 144.15 g/mol, XLogP of 0.67, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-1-(2-methoxyethyl)imidazole is sourced from PubChem (CID 170388204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).