5-chloro-4-(4-methoxyphenyl)-2-methyl-1H-imidazole

C11H11ClN2O — CID 54002462

IUPAC5-chloro-4-(4-methoxyphenyl)-2-methyl-1H-imidazole
SMILESCOc1ccc(-c2nc(C)[nH]c2Cl)cc1
InChIInChI=1S/C11H11ClN2O/c1-7-13-10(11(12)14-7)8-3-5-9(15-2)6-4-8/h3-6H,1-2H3,(H,13,14)
InChIKeyKMORDPFCLFKAPE-UHFFFAOYSA-N
MW222.68 g/mol
LogP3.05
Rot. Bonds2

About 5-chloro-4-(4-methoxyphenyl)-2-methyl-1H-imidazole

5-chloro-4-(4-methoxyphenyl)-2-methyl-1H-imidazole (PubChem CID 54002462) has the molecular formula C11H11ClN2O and a molecular weight of 222.68 g/mol. Its IUPAC name is 5-chloro-4-(4-methoxyphenyl)-2-methyl-1H-imidazole.

Molecular Properties

Compound Name5-chloro-4-(4-methoxyphenyl)-2-methyl-1H-imidazole
PubChem CID54002462
Molecular FormulaC11H11ClN2O
Molecular Weight222.68 g/mol
Exact Mass222.06
IUPAC Name5-chloro-4-(4-methoxyphenyl)-2-methyl-1H-imidazole
SMILESCOc1ccc(-c2nc(C)[nH]c2Cl)cc1
InChIInChI=1S/C11H11ClN2O/c1-7-13-10(11(12)14-7)8-3-5-9(15-2)6-4-8/h3-6H,1-2H3,(H,13,14)
InChIKeyKMORDPFCLFKAPE-UHFFFAOYSA-N
XLogP3.05
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.68
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-chloro-4-(4-methoxyphenyl)-2-methyl-1H-imidazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-chloro-4-(4-methoxyphenyl)-5-methyl-1H-imidazole
CID 105480004
2-chloro-4,5-bis(4-methoxyphenyl)-1H-imidazole;hydrochloride
CID 13394256
2,3-bis(4-methoxyphenyl)-5,6-dimethylpyrazine
CID 14100167
4-(4-methoxyphenyl)-2-methyl-5-tetradecyl-1H-imidazole
CID 59109639
4,5-bis(4-methoxyphenyl)-2H-triazole
CID 24807682
2-chloro-4-(4-methoxyphenyl)-5-methyl-1,3-thiazole
CID 62942162
5-chloro-4-(4-ethoxyphenyl)-1H-imidazol-2-amine
CID 12733709
4,5-bis(4-methoxyphenyl)-2-(4-methylphenyl)-1H-imidazole
CID 1101727
4,5-dichloro-3-(4-methoxyphenyl)-1,2-oxazole
CID 131867696
1-chloro-4-(4-methoxyphenyl)benzene
CID 612791
1,2-dichlorobenzene;1-methoxy-4-methylbenzene
CID 158750380
3-chloro-2,5,6-tris(4-methoxyphenyl)pyridine
CID 122233245

Frequently Asked Questions

What is the IUPAC name of 5-chloro-4-(4-methoxyphenyl)-2-methyl-1H-imidazole?
The IUPAC name of 5-chloro-4-(4-methoxyphenyl)-2-methyl-1H-imidazole (CID 54002462) is 5-chloro-4-(4-methoxyphenyl)-2-methyl-1H-imidazole.
What is the SMILES notation for 5-chloro-4-(4-methoxyphenyl)-2-methyl-1H-imidazole?
The canonical SMILES for 5-chloro-4-(4-methoxyphenyl)-2-methyl-1H-imidazole is COc1ccc(-c2nc(C)[nH]c2Cl)cc1.
What is the InChIKey of 5-chloro-4-(4-methoxyphenyl)-2-methyl-1H-imidazole?
The InChIKey is KMORDPFCLFKAPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11ClN2O/c1-7-13-10(11(12)14-7)8-3-5-9(15-2)6-4-8/h3-6H,1-2H3,(H,13,14).
What are the key properties of 5-chloro-4-(4-methoxyphenyl)-2-methyl-1H-imidazole?
5-chloro-4-(4-methoxyphenyl)-2-methyl-1H-imidazole has a molecular weight of 222.68 g/mol, XLogP of 3.05, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-4-(4-methoxyphenyl)-2-methyl-1H-imidazole is sourced from PubChem (CID 54002462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).