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

C13H16N2O — CID 867238

IUPAC1-[2-(4-ethylphenoxy)ethyl]imidazole
SMILESCCc1ccc(OCCn2ccnc2)cc1
InChIInChI=1S/C13H16N2O/c1-2-12-3-5-13(6-4-12)16-10-9-15-8-7-14-11-15/h3-8,11H,2,9-10H2,1H3
InChIKeyRZTCTGXOVXQJOA-UHFFFAOYSA-N
MW216.28 g/mol
LogP2.52
Rot. Bonds5

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

1-[2-(4-ethylphenoxy)ethyl]imidazole (PubChem CID 867238) has the molecular formula C13H16N2O and a molecular weight of 216.28 g/mol. Its IUPAC name is 1-[2-(4-ethylphenoxy)ethyl]imidazole.

Molecular Properties

Compound Name1-[2-(4-ethylphenoxy)ethyl]imidazole
PubChem CID867238
Molecular FormulaC13H16N2O
Molecular Weight216.28 g/mol
Exact Mass216.13
IUPAC Name1-[2-(4-ethylphenoxy)ethyl]imidazole
SMILESCCc1ccc(OCCn2ccnc2)cc1
InChIInChI=1S/C13H16N2O/c1-2-12-3-5-13(6-4-12)16-10-9-15-8-7-14-11-15/h3-8,11H,2,9-10H2,1H3
InChIKeyRZTCTGXOVXQJOA-UHFFFAOYSA-N
XLogP2.52
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

ethane;1-[2-(4-ethylphenoxy)ethyl]imidazole;propane
CID 164877712
1-[2-(4-methoxyphenoxy)ethyl]imidazole
CID 868397
1-[4-(2-imidazol-1-ylethoxy)phenyl]-N-methylmethanamine
CID 60880613
2-[4-(2-imidazol-1-ylethoxy)phenyl]ethanamine
CID 43253780
propyl 4-(2-imidazol-1-ylethoxy)benzoate
CID 173412849
2-[4-(3-imidazol-1-ylpropoxy)phenyl]ethanol
CID 104601036
1-[4-(3-imidazol-1-ylpropoxy)phenyl]propan-2-one
CID 115495270
3-ethyl-4-[4-(2-imidazol-1-ylethoxy)phenyl]phenol
CID 137341712
dimethyl (Z)-2-[[4-(2-imidazol-1-ylethoxy)phenyl]methyl]-3-propan-2-ylbut-2-enedioate
CID 66648818
1-[2-[4-[[(3S)-3-methoxypyrrolidin-1-yl]methyl]phenoxy]ethyl]imidazole
CID 99926038
N-[2-(4-butylphenoxy)ethyl]-3-imidazol-1-ylpropan-1-amine
CID 18349593
1-[4-(4-chlorophenoxy)butyl]imidazole
CID 2843495

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-ethylphenoxy)ethyl]imidazole?
The IUPAC name of 1-[2-(4-ethylphenoxy)ethyl]imidazole (CID 867238) is 1-[2-(4-ethylphenoxy)ethyl]imidazole.
What is the SMILES notation for 1-[2-(4-ethylphenoxy)ethyl]imidazole?
The canonical SMILES for 1-[2-(4-ethylphenoxy)ethyl]imidazole is CCc1ccc(OCCn2ccnc2)cc1.
What is the InChIKey of 1-[2-(4-ethylphenoxy)ethyl]imidazole?
The InChIKey is RZTCTGXOVXQJOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O/c1-2-12-3-5-13(6-4-12)16-10-9-15-8-7-14-11-15/h3-8,11H,2,9-10H2,1H3.
What are the key properties of 1-[2-(4-ethylphenoxy)ethyl]imidazole?
1-[2-(4-ethylphenoxy)ethyl]imidazole has a molecular weight of 216.28 g/mol, XLogP of 2.52, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-ethylphenoxy)ethyl]imidazole is sourced from PubChem (CID 867238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).