2-(4-bromophenoxy)-1-ethylimidazole

C11H11BrN2O — CID 55209524

IUPAC2-(4-bromophenoxy)-1-ethylimidazole
SMILESCCn1ccnc1Oc1ccc(Br)cc1
InChIInChI=1S/C11H11BrN2O/c1-2-14-8-7-13-11(14)15-10-5-3-9(12)4-6-10/h3-8H,2H2,1H3
InChIKeyIRCPKCKZTLHECA-UHFFFAOYSA-N
MW267.13 g/mol
LogP3.46
Rot. Bonds3

About 2-(4-bromophenoxy)-1-ethylimidazole

2-(4-bromophenoxy)-1-ethylimidazole (PubChem CID 55209524) has the molecular formula C11H11BrN2O and a molecular weight of 267.13 g/mol. Its IUPAC name is 2-(4-bromophenoxy)-1-ethylimidazole.

Molecular Properties

Compound Name2-(4-bromophenoxy)-1-ethylimidazole
PubChem CID55209524
Molecular FormulaC11H11BrN2O
Molecular Weight267.13 g/mol
Exact Mass266.01
IUPAC Name2-(4-bromophenoxy)-1-ethylimidazole
SMILESCCn1ccnc1Oc1ccc(Br)cc1
InChIInChI=1S/C11H11BrN2O/c1-2-14-8-7-13-11(14)15-10-5-3-9(12)4-6-10/h3-8H,2H2,1H3
InChIKeyIRCPKCKZTLHECA-UHFFFAOYSA-N
XLogP3.46
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.13
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1H-Imidazole, 1-(2-phenoxyethyl)-
CID 13569172
1-[3-(4-fluorophenoxy)propyl]-1H-imidazole
CID 2843814
1-(4-bromophenoxy)-3-(1H-imidazol-1-yl)propan-2-ol
CID 2953277
1-[3-(2-fluorophenoxy)propyl]-1H-imidazole
CID 2843524
1-(3-Phenoxypropyl)-1H-imidazole
CID 2841183
1-[3-(4-bromo-2-chlorophenoxy)propyl]-1H-imidazole
CID 2922808
1-[5-(3-Bromophenoxy)pentyl]imidazole
CID 118733120
1-[3-(2-bromo-4-methylphenoxy)propyl]-1H-imidazole
CID 2922618
1-[2-(4-Bromophenoxy)ethyl]-1H-imidazole
CID 867248
1-(4-Phenoxybutyl)imidazole
CID 3682853
1-(2-(3-Bromophenoxy)Ethyl)-1H-Imidazole
CID 803108
1-(6-phenoxyhexyl)-1H-imidazole
CID 3776215

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenoxy)-1-ethylimidazole?
The IUPAC name of 2-(4-bromophenoxy)-1-ethylimidazole (CID 55209524) is 2-(4-bromophenoxy)-1-ethylimidazole.
What is the SMILES notation for 2-(4-bromophenoxy)-1-ethylimidazole?
The canonical SMILES for 2-(4-bromophenoxy)-1-ethylimidazole is CCn1ccnc1Oc1ccc(Br)cc1.
What is the InChIKey of 2-(4-bromophenoxy)-1-ethylimidazole?
The InChIKey is IRCPKCKZTLHECA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11BrN2O/c1-2-14-8-7-13-11(14)15-10-5-3-9(12)4-6-10/h3-8H,2H2,1H3.
What are the key properties of 2-(4-bromophenoxy)-1-ethylimidazole?
2-(4-bromophenoxy)-1-ethylimidazole has a molecular weight of 267.13 g/mol, XLogP of 3.46, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenoxy)-1-ethylimidazole is sourced from PubChem (CID 55209524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).