2-(2-bromo-5-methoxyphenyl)-1H-imidazole

C10H9BrN2O — CID 91367579

IUPAC2-(2-bromo-5-methoxyphenyl)-1H-imidazole
SMILESCOc1ccc(Br)c(-c2ncc[nH]2)c1
InChIInChI=1S/C10H9BrN2O/c1-14-7-2-3-9(11)8(6-7)10-12-4-5-13-10/h2-6H,1H3,(H,12,13)
InChIKeyLKPCGUQPQGWSKE-UHFFFAOYSA-N
MW253.10 g/mol
LogP2.85
Rot. Bonds2

About 2-(2-bromo-5-methoxyphenyl)-1H-imidazole

2-(2-bromo-5-methoxyphenyl)-1H-imidazole (PubChem CID 91367579) has the molecular formula C10H9BrN2O and a molecular weight of 253.10 g/mol. Its IUPAC name is 2-(2-bromo-5-methoxyphenyl)-1H-imidazole.

Molecular Properties

Compound Name2-(2-bromo-5-methoxyphenyl)-1H-imidazole
PubChem CID91367579
Molecular FormulaC10H9BrN2O
Molecular Weight253.10 g/mol
Exact Mass251.99
IUPAC Name2-(2-bromo-5-methoxyphenyl)-1H-imidazole
SMILESCOc1ccc(Br)c(-c2ncc[nH]2)c1
InChIInChI=1S/C10H9BrN2O/c1-14-7-2-3-9(11)8(6-7)10-12-4-5-13-10/h2-6H,1H3,(H,12,13)
InChIKeyLKPCGUQPQGWSKE-UHFFFAOYSA-N
XLogP2.85
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.10
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[2-(furan-3-yl)-5-methoxyphenyl]-1H-imidazole
CID 91520230
2-[2-(4-methoxyphenyl)phenyl]-1H-imidazole
CID 11736810
[2-(2-bromo-5-methoxyphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine
CID 105252149
2-[4-bromo-2-[(4-methoxyphenyl)methylsulfanyl]phenyl]-1H-imidazole
CID 121484920
6-bromo-2-(2-bromo-5-methoxyphenyl)-1H-benzimidazole
CID 64724147
3-(4-methoxy-2-methylphenyl)-1H-pyrazine-2-thione
CID 106518637
2-[3-(1H-imidazol-2-yl)-1,2,4-oxadiazol-5-yl]-5-methoxyaniline
CID 137011816
2-[2,3-dibromo-6-(1H-imidazol-2-yl)phenyl]-1H-imidazole
CID 125475669
2-(3,5-dimethoxyphenyl)-1H-imidazole;dihydrochloride
CID 139785129
1-(2-bromo-4-methoxyphenyl)-N-(1H-imidazol-2-ylmethyl)methanamine
CID 112748930
2,4-dibromo-6-(1H-imidazol-2-yl)benzene-1,3-diol
CID 136822159
2-(2-bromo-4-methoxyphenyl)-1H-pyrrole
CID 167495412

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromo-5-methoxyphenyl)-1H-imidazole?
The IUPAC name of 2-(2-bromo-5-methoxyphenyl)-1H-imidazole (CID 91367579) is 2-(2-bromo-5-methoxyphenyl)-1H-imidazole.
What is the SMILES notation for 2-(2-bromo-5-methoxyphenyl)-1H-imidazole?
The canonical SMILES for 2-(2-bromo-5-methoxyphenyl)-1H-imidazole is COc1ccc(Br)c(-c2ncc[nH]2)c1.
What is the InChIKey of 2-(2-bromo-5-methoxyphenyl)-1H-imidazole?
The InChIKey is LKPCGUQPQGWSKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9BrN2O/c1-14-7-2-3-9(11)8(6-7)10-12-4-5-13-10/h2-6H,1H3,(H,12,13).
What are the key properties of 2-(2-bromo-5-methoxyphenyl)-1H-imidazole?
2-(2-bromo-5-methoxyphenyl)-1H-imidazole has a molecular weight of 253.10 g/mol, XLogP of 2.85, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromo-5-methoxyphenyl)-1H-imidazole is sourced from PubChem (CID 91367579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).