2-bromo-5-(2-methoxy-5-methylphenyl)-1H-imidazole

C11H11BrN2O — CID 116884225

IUPAC2-bromo-5-(2-methoxy-5-methylphenyl)-1H-imidazole
SMILESCOc1ccc(C)cc1-c1cnc(Br)[nH]1
InChIInChI=1S/C11H11BrN2O/c1-7-3-4-10(15-2)8(5-7)9-6-13-11(12)14-9/h3-6H,1-2H3,(H,13,14)
InChIKeyBVMCDGZVHWDZRC-UHFFFAOYSA-N
MW267.13 g/mol
LogP3.16
Rot. Bonds2

About 2-bromo-5-(2-methoxy-5-methylphenyl)-1H-imidazole

2-bromo-5-(2-methoxy-5-methylphenyl)-1H-imidazole (PubChem CID 116884225) has the molecular formula C11H11BrN2O and a molecular weight of 267.13 g/mol. Its IUPAC name is 2-bromo-5-(2-methoxy-5-methylphenyl)-1H-imidazole.

Molecular Properties

Compound Name2-bromo-5-(2-methoxy-5-methylphenyl)-1H-imidazole
PubChem CID116884225
Molecular FormulaC11H11BrN2O
Molecular Weight267.13 g/mol
Exact Mass266.01
IUPAC Name2-bromo-5-(2-methoxy-5-methylphenyl)-1H-imidazole
SMILESCOc1ccc(C)cc1-c1cnc(Br)[nH]1
InChIInChI=1S/C11H11BrN2O/c1-7-3-4-10(15-2)8(5-7)9-6-13-11(12)14-9/h3-6H,1-2H3,(H,13,14)
InChIKeyBVMCDGZVHWDZRC-UHFFFAOYSA-N
XLogP3.16
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.13
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-bromo-5-(2-methoxy-4,5-dimethylphenyl)-1H-imidazole
CID 116884250
[5-(2-methoxy-5-methylphenyl)-1H-imidazol-2-yl]methanethiol
CID 116879145
2-[5-(2-methoxy-5-methylphenyl)-1H-imidazol-2-yl]ethanamine
CID 43650904
3-[5-(2-methoxy-5-methylphenyl)-1H-imidazol-2-yl]propan-1-amine
CID 43650816
3-[5-(2-methoxy-5-methylphenyl)-1H-imidazol-2-yl]cyclobutan-1-amine
CID 116877941
2-amino-2-[5-(2-methoxy-5-methylphenyl)-1H-imidazol-2-yl]acetic acid
CID 116881469
N-[2-[5-(2-methoxy-5-methylphenyl)-1H-imidazol-2-yl]ethyl]cyclopropanamine
CID 60867500
[5-(5-bromo-2-methoxyphenyl)-1H-imidazol-2-yl]methanamine
CID 82307343
2-bromo-5-(2-chloro-4-methoxyphenyl)-1H-imidazole
CID 116884290
2-(4-bromophenyl)-1-methoxy-4-methylbenzene
CID 83665556
2-bromo-5-(4-ethoxy-3-methylphenyl)-1H-imidazole
CID 116884267
2-[5-(5-bromo-2-methoxyphenyl)-1H-imidazol-2-yl]-3-methylbutanenitrile
CID 116883231

Frequently Asked Questions

What is the IUPAC name of 2-bromo-5-(2-methoxy-5-methylphenyl)-1H-imidazole?
The IUPAC name of 2-bromo-5-(2-methoxy-5-methylphenyl)-1H-imidazole (CID 116884225) is 2-bromo-5-(2-methoxy-5-methylphenyl)-1H-imidazole.
What is the SMILES notation for 2-bromo-5-(2-methoxy-5-methylphenyl)-1H-imidazole?
The canonical SMILES for 2-bromo-5-(2-methoxy-5-methylphenyl)-1H-imidazole is COc1ccc(C)cc1-c1cnc(Br)[nH]1.
What is the InChIKey of 2-bromo-5-(2-methoxy-5-methylphenyl)-1H-imidazole?
The InChIKey is BVMCDGZVHWDZRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11BrN2O/c1-7-3-4-10(15-2)8(5-7)9-6-13-11(12)14-9/h3-6H,1-2H3,(H,13,14).
What are the key properties of 2-bromo-5-(2-methoxy-5-methylphenyl)-1H-imidazole?
2-bromo-5-(2-methoxy-5-methylphenyl)-1H-imidazole has a molecular weight of 267.13 g/mol, XLogP of 3.16, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-5-(2-methoxy-5-methylphenyl)-1H-imidazole is sourced from PubChem (CID 116884225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).