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

C14H18N2O — CID 63678506

IUPAC1-ethyl-2-[(4-ethylphenoxy)methyl]imidazole
SMILESCCc1ccc(OCc2nccn2CC)cc1
InChIInChI=1S/C14H18N2O/c1-3-12-5-7-13(8-6-12)17-11-14-15-9-10-16(14)4-2/h5-10H,3-4,11H2,1-2H3
InChIKeyCAMZLHJAUGURFH-UHFFFAOYSA-N
MW230.31 g/mol
LogP3.04
Rot. Bonds5

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

1-ethyl-2-[(4-ethylphenoxy)methyl]imidazole (PubChem CID 63678506) has the molecular formula C14H18N2O and a molecular weight of 230.31 g/mol. Its IUPAC name is 1-ethyl-2-[(4-ethylphenoxy)methyl]imidazole.

Molecular Properties

Compound Name1-ethyl-2-[(4-ethylphenoxy)methyl]imidazole
PubChem CID63678506
Molecular FormulaC14H18N2O
Molecular Weight230.31 g/mol
Exact Mass230.14
IUPAC Name1-ethyl-2-[(4-ethylphenoxy)methyl]imidazole
SMILESCCc1ccc(OCc2nccn2CC)cc1
InChIInChI=1S/C14H18N2O/c1-3-12-5-7-13(8-6-12)17-11-14-15-9-10-16(14)4-2/h5-10H,3-4,11H2,1-2H3
InChIKeyCAMZLHJAUGURFH-UHFFFAOYSA-N
XLogP3.04
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-[(1-ethylimidazol-2-yl)methoxy]phenyl]-N-methylpropan-2-amine
CID 115494639
4-[4-[(1-ethylimidazol-2-yl)methoxy]phenyl]butan-2-amine
CID 62737524
4-[(1-ethylimidazol-2-yl)methoxy]benzenesulfonamide
CID 78990443
(1S)-1-[4-[(1-ethylimidazol-2-yl)methoxy]phenyl]propan-1-ol
CID 78932314
1-[4-[(1-ethylimidazol-2-yl)methoxy]phenyl]propan-1-one
CID 62406936
N-ethyl-1-[4-[(1-ethylimidazol-2-yl)methoxy]phenyl]ethanamine
CID 62738073
2-[(6-bromonaphthalen-2-yl)oxymethyl]-1-ethylimidazole
CID 62736409
[5-[(1-ethylimidazol-2-yl)methoxy]-2-pyridinyl]methanol
CID 79799356
1-(1-ethylimidazol-2-yl)-2-(4-ethylphenyl)propan-2-ol
CID 79744037
N-[(1-ethylimidazol-2-yl)methyl]-2-(4-methoxyphenyl)ethanamine
CID 46784377
2-[[4-(chloromethyl)phenoxy]methyl]-1-methylimidazole;hydrochloride
CID 42962680
1-[2-[(1-ethylimidazol-2-yl)methoxy]-4-methoxyphenyl]-N-methylmethanamine
CID 62736957

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2-[(4-ethylphenoxy)methyl]imidazole?
The IUPAC name of 1-ethyl-2-[(4-ethylphenoxy)methyl]imidazole (CID 63678506) is 1-ethyl-2-[(4-ethylphenoxy)methyl]imidazole.
What is the SMILES notation for 1-ethyl-2-[(4-ethylphenoxy)methyl]imidazole?
The canonical SMILES for 1-ethyl-2-[(4-ethylphenoxy)methyl]imidazole is CCc1ccc(OCc2nccn2CC)cc1.
What is the InChIKey of 1-ethyl-2-[(4-ethylphenoxy)methyl]imidazole?
The InChIKey is CAMZLHJAUGURFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O/c1-3-12-5-7-13(8-6-12)17-11-14-15-9-10-16(14)4-2/h5-10H,3-4,11H2,1-2H3.
What are the key properties of 1-ethyl-2-[(4-ethylphenoxy)methyl]imidazole?
1-ethyl-2-[(4-ethylphenoxy)methyl]imidazole has a molecular weight of 230.31 g/mol, XLogP of 3.04, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2-[(4-ethylphenoxy)methyl]imidazole is sourced from PubChem (CID 63678506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).