2-(2-bromo-4-methoxyphenoxy)-1-ethylimidazole

C12H13BrN2O2 — CID 104707547

IUPAC2-(2-bromo-4-methoxyphenoxy)-1-ethylimidazole
SMILESCCn1ccnc1Oc1ccc(OC)cc1Br
InChIInChI=1S/C12H13BrN2O2/c1-3-15-7-6-14-12(15)17-11-5-4-9(16-2)8-10(11)13/h4-8H,3H2,1-2H3
InChIKeyLEWCAEJWBUWFJE-UHFFFAOYSA-N
MW297.15 g/mol
LogP3.47
Rot. Bonds4

About 2-(2-bromo-4-methoxyphenoxy)-1-ethylimidazole

2-(2-bromo-4-methoxyphenoxy)-1-ethylimidazole (PubChem CID 104707547) has the molecular formula C12H13BrN2O2 and a molecular weight of 297.15 g/mol. Its IUPAC name is 2-(2-bromo-4-methoxyphenoxy)-1-ethylimidazole.

Molecular Properties

Compound Name2-(2-bromo-4-methoxyphenoxy)-1-ethylimidazole
PubChem CID104707547
Molecular FormulaC12H13BrN2O2
Molecular Weight297.15 g/mol
Exact Mass296.02
IUPAC Name2-(2-bromo-4-methoxyphenoxy)-1-ethylimidazole
SMILESCCn1ccnc1Oc1ccc(OC)cc1Br
InChIInChI=1S/C12H13BrN2O2/c1-3-15-7-6-14-12(15)17-11-5-4-9(16-2)8-10(11)13/h4-8H,3H2,1-2H3
InChIKeyLEWCAEJWBUWFJE-UHFFFAOYSA-N
XLogP3.47
TPSA36.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.15
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(2-bromo-4-methoxyphenoxy)-1-ethylimidazole 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

2-(3-bromo-4-fluorophenoxy)-1-ethylimidazole
CID 83234113
3-(1-ethylimidazol-2-yl)oxy-4-methoxybenzoic acid
CID 79732848
4-bromo-3-(1-ethylimidazol-2-yl)oxybenzoic acid
CID 114103552
(2,5-dimethoxyphenyl)-(1-ethylimidazol-2-yl)methanol
CID 3140475
4-bromo-2-(1-ethylimidazol-2-yl)oxybenzoic acid
CID 62138804
[(2,5-dimethoxyphenyl)-(1-ethylimidazol-2-yl)methyl]hydrazine
CID 105308368
N-[(2,4-dimethoxyphenyl)methyl]-1-ethylimidazol-2-amine
CID 63362794
N-[(3-bromo-4-methoxyphenyl)-(1-ethylimidazol-2-yl)methyl]ethanamine
CID 61314643
4-(1-ethylimidazol-2-yl)oxy-3-methylbenzoic acid
CID 107672719
2-(2-bromo-4-methoxyphenoxy)-4-methylpyrimidine
CID 104707648
2-(2-bromo-4-methylphenoxy)-1-methylimidazole
CID 62132553
2-[(2-bromo-4-methylphenoxy)methyl]-1-ethylimidazole
CID 62736045

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromo-4-methoxyphenoxy)-1-ethylimidazole?
The IUPAC name of 2-(2-bromo-4-methoxyphenoxy)-1-ethylimidazole (CID 104707547) is 2-(2-bromo-4-methoxyphenoxy)-1-ethylimidazole.
What is the SMILES notation for 2-(2-bromo-4-methoxyphenoxy)-1-ethylimidazole?
The canonical SMILES for 2-(2-bromo-4-methoxyphenoxy)-1-ethylimidazole is CCn1ccnc1Oc1ccc(OC)cc1Br.
What is the InChIKey of 2-(2-bromo-4-methoxyphenoxy)-1-ethylimidazole?
The InChIKey is LEWCAEJWBUWFJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13BrN2O2/c1-3-15-7-6-14-12(15)17-11-5-4-9(16-2)8-10(11)13/h4-8H,3H2,1-2H3.
What are the key properties of 2-(2-bromo-4-methoxyphenoxy)-1-ethylimidazole?
2-(2-bromo-4-methoxyphenoxy)-1-ethylimidazole has a molecular weight of 297.15 g/mol, XLogP of 3.47, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromo-4-methoxyphenoxy)-1-ethylimidazole is sourced from PubChem (CID 104707547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).