5-chloro-2-(2-methoxyphenyl)-1-methylimidazole

C11H11ClN2O — CID 117259261

IUPAC5-chloro-2-(2-methoxyphenyl)-1-methylimidazole
SMILESCOc1ccccc1-c1ncc(Cl)n1C
InChIInChI=1S/C11H11ClN2O/c1-14-10(12)7-13-11(14)8-5-3-4-6-9(8)15-2/h3-7H,1-2H3
InChIKeyDZAZGDFZVNLRBM-UHFFFAOYSA-N
MW222.68 g/mol
LogP2.75
Rot. Bonds2

About 5-chloro-2-(2-methoxyphenyl)-1-methylimidazole

5-chloro-2-(2-methoxyphenyl)-1-methylimidazole (PubChem CID 117259261) has the molecular formula C11H11ClN2O and a molecular weight of 222.68 g/mol. Its IUPAC name is 5-chloro-2-(2-methoxyphenyl)-1-methylimidazole.

Molecular Properties

Compound Name5-chloro-2-(2-methoxyphenyl)-1-methylimidazole
PubChem CID117259261
Molecular FormulaC11H11ClN2O
Molecular Weight222.68 g/mol
Exact Mass222.06
IUPAC Name5-chloro-2-(2-methoxyphenyl)-1-methylimidazole
SMILESCOc1ccccc1-c1ncc(Cl)n1C
InChIInChI=1S/C11H11ClN2O/c1-14-10(12)7-13-11(14)8-5-3-4-6-9(8)15-2/h3-7H,1-2H3
InChIKeyDZAZGDFZVNLRBM-UHFFFAOYSA-N
XLogP2.75
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.68
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(5-chloro-1-methylimidazol-2-yl)phenol
CID 137000627
2-(2-methoxyphenyl)-1-(4-methylphenyl)imidazole
CID 141122425
2-(2-methoxyphenyl)-5-methylpyrimidine
CID 155698550
2-[3-chloro-5-(2-methoxyphenyl)-1,2,4-triazol-1-yl]pyrimidine
CID 30032947
3-chloro-4-(2-methoxyphenyl)pyridine
CID 134375392
6-chloro-3-(2-methoxyphenyl)-[1,2,4]triazolo[4,3-b]pyridazine
CID 43327050
3-chloro-1-(4-chlorophenyl)-5-(2-methoxyphenyl)-1,2,4-triazole
CID 30032770
4-(2-methoxyphenyl)-2,5-dimethylpyridine
CID 155353771
4-chloro-2-(2-methoxyphenyl)-1,3-thiazole
CID 83158767
2-(2-chlorophenyl)-3-methylimidazol-4-ol
CID 19743684
3-[6-chloro-2-(2-methoxyphenyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol
CID 94757541
3-(2-methoxyphenyl)-1,2,4-triazol-4-amine
CID 54284537

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-(2-methoxyphenyl)-1-methylimidazole?
The IUPAC name of 5-chloro-2-(2-methoxyphenyl)-1-methylimidazole (CID 117259261) is 5-chloro-2-(2-methoxyphenyl)-1-methylimidazole.
What is the SMILES notation for 5-chloro-2-(2-methoxyphenyl)-1-methylimidazole?
The canonical SMILES for 5-chloro-2-(2-methoxyphenyl)-1-methylimidazole is COc1ccccc1-c1ncc(Cl)n1C.
What is the InChIKey of 5-chloro-2-(2-methoxyphenyl)-1-methylimidazole?
The InChIKey is DZAZGDFZVNLRBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11ClN2O/c1-14-10(12)7-13-11(14)8-5-3-4-6-9(8)15-2/h3-7H,1-2H3.
What are the key properties of 5-chloro-2-(2-methoxyphenyl)-1-methylimidazole?
5-chloro-2-(2-methoxyphenyl)-1-methylimidazole has a molecular weight of 222.68 g/mol, XLogP of 2.75, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-(2-methoxyphenyl)-1-methylimidazole is sourced from PubChem (CID 117259261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).