1-(2-methoxy-4-methylphenyl)-2,4-dimethylimidazole

C13H16N2O — CID 91609134

IUPAC1-(2-methoxy-4-methylphenyl)-2,4-dimethylimidazole
SMILESCOc1cc(C)ccc1-n1cc(C)nc1C
InChIInChI=1S/C13H16N2O/c1-9-5-6-12(13(7-9)16-4)15-8-10(2)14-11(15)3/h5-8H,1-4H3
InChIKeyPVTNRUMYFQSUGI-UHFFFAOYSA-N
MW216.28 g/mol
LogP2.81
Rot. Bonds2

About 1-(2-methoxy-4-methylphenyl)-2,4-dimethylimidazole

1-(2-methoxy-4-methylphenyl)-2,4-dimethylimidazole (PubChem CID 91609134) has the molecular formula C13H16N2O and a molecular weight of 216.28 g/mol. Its IUPAC name is 1-(2-methoxy-4-methylphenyl)-2,4-dimethylimidazole.

Molecular Properties

Compound Name1-(2-methoxy-4-methylphenyl)-2,4-dimethylimidazole
PubChem CID91609134
Molecular FormulaC13H16N2O
Molecular Weight216.28 g/mol
Exact Mass216.13
IUPAC Name1-(2-methoxy-4-methylphenyl)-2,4-dimethylimidazole
SMILESCOc1cc(C)ccc1-n1cc(C)nc1C
InChIInChI=1S/C13H16N2O/c1-9-5-6-12(13(7-9)16-4)15-8-10(2)14-11(15)3/h5-8H,1-4H3
InChIKeyPVTNRUMYFQSUGI-UHFFFAOYSA-N
XLogP2.81
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-(2,4-dimethylimidazol-1-yl)-4-methoxyaniline
CID 82512676
1-(2-methoxy-5-methylphenyl)-N,4-dimethylimidazol-2-amine
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2-(2-methoxy-4-methylphenyl)triazole
CID 174665520
ethane;1-(5-fluoro-3-methoxy-2-nitrophenyl)-2,4-dimethylimidazole
CID 143812513
1-(2,4-dimethoxyphenyl)-2-methylimidazole-4-carboxylic acid
CID 82302613
11-(2-methoxy-4-methylphenyl)benzo[c][1,2,5]benzotriazepine
CID 70829365
1-(2-methoxy-4-methylphenyl)piperazine
CID 10488507
11-(2-methoxy-4-methylphenyl)benzo[b][1]benzazepine
CID 59572704
1-(2-fluoro-4-methylphenyl)-4-methylimidazol-2-amine
CID 106560440
carbon dioxide;4-ethyl-1-[2-methoxy-4-(3,3,3-trifluoro-2,2-dimethylpropyl)phenyl]-2-methylimidazole
CID 161311196
1-(2-methoxyphenyl)-6-methylindole
CID 150985868
CID 131844912
CID 131844912

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxy-4-methylphenyl)-2,4-dimethylimidazole?
The IUPAC name of 1-(2-methoxy-4-methylphenyl)-2,4-dimethylimidazole (CID 91609134) is 1-(2-methoxy-4-methylphenyl)-2,4-dimethylimidazole.
What is the SMILES notation for 1-(2-methoxy-4-methylphenyl)-2,4-dimethylimidazole?
The canonical SMILES for 1-(2-methoxy-4-methylphenyl)-2,4-dimethylimidazole is COc1cc(C)ccc1-n1cc(C)nc1C.
What is the InChIKey of 1-(2-methoxy-4-methylphenyl)-2,4-dimethylimidazole?
The InChIKey is PVTNRUMYFQSUGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O/c1-9-5-6-12(13(7-9)16-4)15-8-10(2)14-11(15)3/h5-8H,1-4H3.
What are the key properties of 1-(2-methoxy-4-methylphenyl)-2,4-dimethylimidazole?
1-(2-methoxy-4-methylphenyl)-2,4-dimethylimidazole has a molecular weight of 216.28 g/mol, XLogP of 2.81, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxy-4-methylphenyl)-2,4-dimethylimidazole is sourced from PubChem (CID 91609134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).