4-[(4-methoxyphenoxy)methyl]-1,2-dimethylimidazole

C13H16N2O2 — CID 117191574

IUPAC4-[(4-methoxyphenoxy)methyl]-1,2-dimethylimidazole
SMILESCOc1ccc(OCc2cn(C)c(C)n2)cc1
InChIInChI=1S/C13H16N2O2/c1-10-14-11(8-15(10)2)9-17-13-6-4-12(16-3)5-7-13/h4-8H,9H2,1-3H3
InChIKeySRPICUQGDDJHIH-UHFFFAOYSA-N
MW232.28 g/mol
LogP2.32
Rot. Bonds4

About 4-[(4-methoxyphenoxy)methyl]-1,2-dimethylimidazole

4-[(4-methoxyphenoxy)methyl]-1,2-dimethylimidazole (PubChem CID 117191574) has the molecular formula C13H16N2O2 and a molecular weight of 232.28 g/mol. Its IUPAC name is 4-[(4-methoxyphenoxy)methyl]-1,2-dimethylimidazole.

Molecular Properties

Compound Name4-[(4-methoxyphenoxy)methyl]-1,2-dimethylimidazole
PubChem CID117191574
Molecular FormulaC13H16N2O2
Molecular Weight232.28 g/mol
Exact Mass232.12
IUPAC Name4-[(4-methoxyphenoxy)methyl]-1,2-dimethylimidazole
SMILESCOc1ccc(OCc2cn(C)c(C)n2)cc1
InChIInChI=1S/C13H16N2O2/c1-10-14-11(8-15(10)2)9-17-13-6-4-12(16-3)5-7-13/h4-8H,9H2,1-3H3
InChIKeySRPICUQGDDJHIH-UHFFFAOYSA-N
XLogP2.32
TPSA36.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-methyl-4-(phenoxymethyl)imidazol-2-amine
CID 117191438
4-[(4-bromophenoxy)methyl]-2-methyl-1-propan-2-ylimidazole
CID 117191982
[3-[(4-methoxyphenoxy)methyl]-1,2,4-oxadiazol-5-yl]methanamine;hydrochloride
CID 51051991
methyl 2-[(4-methoxyphenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylate
CID 117255839
1-methyl-4-[[4-(trifluoromethyl)phenoxy]methyl]imidazole-2-carboxylic acid
CID 117191700
methyl 2-[(4-methoxyphenoxy)methyl]imidazo[1,2-a]pyridine-6-carboxylate
CID 117256154
4-[(2-methoxyphenoxy)methyl]-1-methylimidazol-2-amine
CID 117191477
1-[2-(4-methoxyphenoxy)ethyl]-2-methylimidazole
CID 887351
methyl 2-[(4-methoxyphenoxy)methyl]imidazo[1,2-a]pyridine-8-carboxylate
CID 117256766
2-bromo-4-[(4-methylphenoxy)methyl]-1-propan-2-ylimidazole
CID 117191965
1-methoxy-4-tetradecoxybenzene
CID 91712423
4-[(4-methoxyphenyl)methoxy]pyridine
CID 54365889

Frequently Asked Questions

What is the IUPAC name of 4-[(4-methoxyphenoxy)methyl]-1,2-dimethylimidazole?
The IUPAC name of 4-[(4-methoxyphenoxy)methyl]-1,2-dimethylimidazole (CID 117191574) is 4-[(4-methoxyphenoxy)methyl]-1,2-dimethylimidazole.
What is the SMILES notation for 4-[(4-methoxyphenoxy)methyl]-1,2-dimethylimidazole?
The canonical SMILES for 4-[(4-methoxyphenoxy)methyl]-1,2-dimethylimidazole is COc1ccc(OCc2cn(C)c(C)n2)cc1.
What is the InChIKey of 4-[(4-methoxyphenoxy)methyl]-1,2-dimethylimidazole?
The InChIKey is SRPICUQGDDJHIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O2/c1-10-14-11(8-15(10)2)9-17-13-6-4-12(16-3)5-7-13/h4-8H,9H2,1-3H3.
What are the key properties of 4-[(4-methoxyphenoxy)methyl]-1,2-dimethylimidazole?
4-[(4-methoxyphenoxy)methyl]-1,2-dimethylimidazole has a molecular weight of 232.28 g/mol, XLogP of 2.32, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-methoxyphenoxy)methyl]-1,2-dimethylimidazole is sourced from PubChem (CID 117191574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).