1-hydroxy-2-(4-methoxyphenyl)-4,5-dimethylimidazole

C12H14N2O2 — CID 124791165

IUPAC1-hydroxy-2-(4-methoxyphenyl)-4,5-dimethylimidazole
SMILESCOc1ccc(-c2nc(C)c(C)n2O)cc1
InChIInChI=1S/C12H14N2O2/c1-8-9(2)14(15)12(13-8)10-4-6-11(16-3)7-5-10/h4-7,15H,1-3H3
InChIKeyGEDRVQSMDFOYOD-UHFFFAOYSA-N
MW218.26 g/mol
LogP2.41
Rot. Bonds2

About 1-hydroxy-2-(4-methoxyphenyl)-4,5-dimethylimidazole

1-hydroxy-2-(4-methoxyphenyl)-4,5-dimethylimidazole (PubChem CID 124791165) has the molecular formula C12H14N2O2 and a molecular weight of 218.26 g/mol. Its IUPAC name is 1-hydroxy-2-(4-methoxyphenyl)-4,5-dimethylimidazole.

Molecular Properties

Compound Name1-hydroxy-2-(4-methoxyphenyl)-4,5-dimethylimidazole
PubChem CID124791165
Molecular FormulaC12H14N2O2
Molecular Weight218.26 g/mol
Exact Mass218.11
IUPAC Name1-hydroxy-2-(4-methoxyphenyl)-4,5-dimethylimidazole
SMILESCOc1ccc(-c2nc(C)c(C)n2O)cc1
InChIInChI=1S/C12H14N2O2/c1-8-9(2)14(15)12(13-8)10-4-6-11(16-3)7-5-10/h4-7,15H,1-3H3
InChIKeyGEDRVQSMDFOYOD-UHFFFAOYSA-N
XLogP2.41
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-hydroxyl_pyridine', 'substructure': 'N/A'}

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Related Compounds

1-hydroxy-2-(4-methoxyphenyl)-4-methylbenzimidazole
CID 15514766
2,3-bis(4-methoxyphenyl)-5,6-dimethylpyrazine
CID 14100167
1-(113C)methoxy-4-methylbenzene
CID 166176950
[4-(1-acetyloxy-4,5-dimethylimidazol-2-yl)phenyl] acetate
CID 134109867
methane;1-methoxy-4-(4-methylphenyl)benzene
CID 159881054
6-(4-methoxyphenyl)-1,4,5,7-tetramethylpyrrolo[3,4-d]pyridazine
CID 715491
methyl 2,6-bis(4-methoxyphenyl)-5-methylpyrimidine-4-carboxylate
CID 90960617
5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-amine
CID 35754869
2,4,6-tris[4-(4-methoxyphenyl)phenyl]-1,3,5-triazine
CID 20652062
4-(1,4,5-trimethylimidazol-2-yl)phenol
CID 135971971
4-[4-methoxycarbonyl-2-(4-methoxyphenyl)-5-methylimidazol-1-yl]benzoic acid
CID 45157100
1,4-dimethoxybenzene;ethane;methane;1,4-xylene
CID 161140185

Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-2-(4-methoxyphenyl)-4,5-dimethylimidazole?
The IUPAC name of 1-hydroxy-2-(4-methoxyphenyl)-4,5-dimethylimidazole (CID 124791165) is 1-hydroxy-2-(4-methoxyphenyl)-4,5-dimethylimidazole.
What is the SMILES notation for 1-hydroxy-2-(4-methoxyphenyl)-4,5-dimethylimidazole?
The canonical SMILES for 1-hydroxy-2-(4-methoxyphenyl)-4,5-dimethylimidazole is COc1ccc(-c2nc(C)c(C)n2O)cc1.
What is the InChIKey of 1-hydroxy-2-(4-methoxyphenyl)-4,5-dimethylimidazole?
The InChIKey is GEDRVQSMDFOYOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2/c1-8-9(2)14(15)12(13-8)10-4-6-11(16-3)7-5-10/h4-7,15H,1-3H3.
What are the key properties of 1-hydroxy-2-(4-methoxyphenyl)-4,5-dimethylimidazole?
1-hydroxy-2-(4-methoxyphenyl)-4,5-dimethylimidazole has a molecular weight of 218.26 g/mol, XLogP of 2.41, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-2-(4-methoxyphenyl)-4,5-dimethylimidazole is sourced from PubChem (CID 124791165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).