1-[2-(4-methoxyphenoxy)ethyl]imidazole

C12H14N2O2 — CID 868397

IUPAC1-[2-(4-methoxyphenoxy)ethyl]imidazole
SMILESCOc1ccc(OCCn2ccnc2)cc1
InChIInChI=1S/C12H14N2O2/c1-15-11-2-4-12(5-3-11)16-9-8-14-7-6-13-10-14/h2-7,10H,8-9H2,1H3
InChIKeyDIPAJZPYPXKOFG-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.97
Rot. Bonds5

About 1-[2-(4-methoxyphenoxy)ethyl]imidazole

1-[2-(4-methoxyphenoxy)ethyl]imidazole (PubChem CID 868397) has the molecular formula C12H14N2O2 and a molecular weight of 218.26 g/mol. Its IUPAC name is 1-[2-(4-methoxyphenoxy)ethyl]imidazole.

Molecular Properties

Compound Name1-[2-(4-methoxyphenoxy)ethyl]imidazole
PubChem CID868397
Molecular FormulaC12H14N2O2
Molecular Weight218.26 g/mol
Exact Mass218.11
IUPAC Name1-[2-(4-methoxyphenoxy)ethyl]imidazole
SMILESCOc1ccc(OCCn2ccnc2)cc1
InChIInChI=1S/C12H14N2O2/c1-15-11-2-4-12(5-3-11)16-9-8-14-7-6-13-10-14/h2-7,10H,8-9H2,1H3
InChIKeyDIPAJZPYPXKOFG-UHFFFAOYSA-N
XLogP1.97
TPSA36.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(4-ethylphenoxy)ethyl]imidazole
CID 867238
ethane;1-[2-(4-ethylphenoxy)ethyl]imidazole;propane
CID 164877712
1-[4-(2-imidazol-1-ylethoxy)phenyl]-N-methylmethanamine
CID 60880613
2-[4-(2-imidazol-1-ylethoxy)phenyl]ethanamine
CID 43253780
2-[2-(2-imidazol-1-ylethoxy)-5-methoxyphenyl]ethanamine
CID 54931279
N-[[2-(2-imidazol-1-ylethoxy)-5-methoxyphenyl]methyl]propan-2-amine
CID 60878720
1-[6-(3-methoxyphenoxy)hexyl]imidazole
CID 3758429
propyl 4-(2-imidazol-1-ylethoxy)benzoate
CID 173412849
1-[4-(4-chlorophenoxy)butyl]imidazole
CID 2843495
1-[4-(4-fluorophenoxy)butyl]imidazole
CID 31196577
1-(2-methoxyethyl)imidazole
CID 14366840
4-[4-(2-imidazol-1-ylethoxy)phenyl]-3,5-dimethyl-1H-pyrazole
CID 72883086

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-methoxyphenoxy)ethyl]imidazole?
The IUPAC name of 1-[2-(4-methoxyphenoxy)ethyl]imidazole (CID 868397) is 1-[2-(4-methoxyphenoxy)ethyl]imidazole.
What is the SMILES notation for 1-[2-(4-methoxyphenoxy)ethyl]imidazole?
The canonical SMILES for 1-[2-(4-methoxyphenoxy)ethyl]imidazole is COc1ccc(OCCn2ccnc2)cc1.
What is the InChIKey of 1-[2-(4-methoxyphenoxy)ethyl]imidazole?
The InChIKey is DIPAJZPYPXKOFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2/c1-15-11-2-4-12(5-3-11)16-9-8-14-7-6-13-10-14/h2-7,10H,8-9H2,1H3.
What are the key properties of 1-[2-(4-methoxyphenoxy)ethyl]imidazole?
1-[2-(4-methoxyphenoxy)ethyl]imidazole has a molecular weight of 218.26 g/mol, XLogP of 1.97, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-methoxyphenoxy)ethyl]imidazole is sourced from PubChem (CID 868397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).