1-[(3,5-dimethylphenyl)methoxy]imidazole

C12H14N2O — CID 1491089

IUPAC1-[(3,5-dimethylphenyl)methoxy]imidazole
SMILESCc1cc(C)cc(COn2ccnc2)c1
InChIInChI=1S/C12H14N2O/c1-10-5-11(2)7-12(6-10)8-15-14-4-3-13-9-14/h3-7,9H,8H2,1-2H3
InChIKeyXZOKMCRHCVZZRU-UHFFFAOYSA-N
MW202.26 g/mol
LogP2.13
Rot. Bonds3

About 1-[(3,5-dimethylphenyl)methoxy]imidazole

1-[(3,5-dimethylphenyl)methoxy]imidazole (PubChem CID 1491089) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is 1-[(3,5-dimethylphenyl)methoxy]imidazole.

Molecular Properties

Compound Name1-[(3,5-dimethylphenyl)methoxy]imidazole
PubChem CID1491089
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC Name1-[(3,5-dimethylphenyl)methoxy]imidazole
SMILESCc1cc(C)cc(COn2ccnc2)c1
InChIInChI=1S/C12H14N2O/c1-10-5-11(2)7-12(6-10)8-15-14-4-3-13-9-14/h3-7,9H,8H2,1-2H3
InChIKeyXZOKMCRHCVZZRU-UHFFFAOYSA-N
XLogP2.13
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 52.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

{3-[(1H-imidazol-1-yl)methyl]phenyl}methanol
CID 10397593
1-(phenethyloxy)-1H-imidazole
CID 1491082
1-[(4-bromobenzyl)oxy]-1H-imidazole
CID 1491058
1-(2-(Benzyloxy)ethyl)imidazole
CID 4146595
1-[(3,4-dichlorobenzyl)oxy]-1H-imidazole
CID 1475033
1-(3-benzyloxy-1(E)octenyl)imidazole
CID 6436121
2-Methyl-1-[2-[(3-methylphenyl)methoxy]ethyl]-5-nitroimidazole
CID 164611486
1-[[4-(1,1-Dimethylethyl)phenyl]methoxy]-1H-imidazole
CID 1491084
1H-Imidazolium, 2-((hydroxyimino)methyl)-3-methyl-1-(((1-phenylbutyl)oxy)methyl)-, chloride
CID 135705507
1H-Imidazolium, 2-((hydroxyimino)methyl)-3-methyl-1-(((phenylmethyl)oxy)methyl)-, chloride
CID 135705511
(NE)-N-[[1-[(4-fluorophenyl)methoxymethyl]-3-methylimidazol-3-ium-2-yl]methylidene]hydroxylamine chloride
CID 135789875
1-(benzyloxy)-1H-imidazole
CID 639155

Frequently Asked Questions

What is the IUPAC name of 1-[(3,5-dimethylphenyl)methoxy]imidazole?
The IUPAC name of 1-[(3,5-dimethylphenyl)methoxy]imidazole (CID 1491089) is 1-[(3,5-dimethylphenyl)methoxy]imidazole.
What is the SMILES notation for 1-[(3,5-dimethylphenyl)methoxy]imidazole?
The canonical SMILES for 1-[(3,5-dimethylphenyl)methoxy]imidazole is Cc1cc(C)cc(COn2ccnc2)c1.
What is the InChIKey of 1-[(3,5-dimethylphenyl)methoxy]imidazole?
The InChIKey is XZOKMCRHCVZZRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-10-5-11(2)7-12(6-10)8-15-14-4-3-13-9-14/h3-7,9H,8H2,1-2H3.
What are the key properties of 1-[(3,5-dimethylphenyl)methoxy]imidazole?
1-[(3,5-dimethylphenyl)methoxy]imidazole has a molecular weight of 202.26 g/mol, XLogP of 2.13, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3,5-dimethylphenyl)methoxy]imidazole is sourced from PubChem (CID 1491089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).