5-(5-chloro-4-methoxy-2-methylphenyl)-2-methoxy-1H-imidazole

C12H13ClN2O2 — CID 116883699

IUPAC5-(5-chloro-4-methoxy-2-methylphenyl)-2-methoxy-1H-imidazole
SMILESCOc1ncc(-c2cc(Cl)c(OC)cc2C)[nH]1
InChIInChI=1S/C12H13ClN2O2/c1-7-4-11(16-2)9(13)5-8(7)10-6-14-12(15-10)17-3/h4-6H,1-3H3,(H,14,15)
InChIKeyQLDHIYJKWGFXNB-UHFFFAOYSA-N
MW252.70 g/mol
LogP3.06
Rot. Bonds3

About 5-(5-chloro-4-methoxy-2-methylphenyl)-2-methoxy-1H-imidazole

5-(5-chloro-4-methoxy-2-methylphenyl)-2-methoxy-1H-imidazole (PubChem CID 116883699) has the molecular formula C12H13ClN2O2 and a molecular weight of 252.70 g/mol. Its IUPAC name is 5-(5-chloro-4-methoxy-2-methylphenyl)-2-methoxy-1H-imidazole.

Molecular Properties

Compound Name5-(5-chloro-4-methoxy-2-methylphenyl)-2-methoxy-1H-imidazole
PubChem CID116883699
Molecular FormulaC12H13ClN2O2
Molecular Weight252.70 g/mol
Exact Mass252.07
IUPAC Name5-(5-chloro-4-methoxy-2-methylphenyl)-2-methoxy-1H-imidazole
SMILESCOc1ncc(-c2cc(Cl)c(OC)cc2C)[nH]1
InChIInChI=1S/C12H13ClN2O2/c1-7-4-11(16-2)9(13)5-8(7)10-6-14-12(15-10)17-3/h4-6H,1-3H3,(H,14,15)
InChIKeyQLDHIYJKWGFXNB-UHFFFAOYSA-N
XLogP3.06
TPSA47.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.70
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-(5-chloro-4-methoxy-2-methylphenyl)-2-methoxy-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-5-(5-chloro-4-methoxy-2-methylphenyl)-1H-imidazole
CID 116884397
5-(5-bromo-2-methylphenyl)-2-methoxy-1H-imidazole
CID 116883755
[5-(5-chloro-4-ethoxy-2-methylphenyl)-1H-imidazol-2-yl]methanamine
CID 82304282
5-(4-chloro-2-fluoro-5-methoxyphenyl)-2-methyl-1H-imidazole
CID 67853105
1-[5-(5-chloro-2-methoxy-4-methylphenyl)-1H-imidazol-2-yl]ethanone
CID 116880660
5-(3-chloro-4-ethoxyphenyl)-2-methoxy-1H-imidazole
CID 116883702
2-[5-(5-chloro-2-methoxy-4-methylphenyl)-1H-imidazol-2-yl]ethanamine
CID 82304273
2-bromo-5-(2-methoxy-4,5-dimethylphenyl)-1H-imidazole
CID 116884250
1-[5-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-1H-imidazol-2-yl]-N-methylmethanamine
CID 95475764
4-(5-chloro-4-methoxy-2-methylphenyl)-5-methylthiophen-2-amine
CID 82487480
2-[5-(4-methoxy-2,5-dimethylphenyl)-1H-imidazol-2-yl]butanenitrile
CID 116883139
5-(2-fluorophenyl)-2-methoxy-1H-imidazole
CID 116883763

Frequently Asked Questions

What is the IUPAC name of 5-(5-chloro-4-methoxy-2-methylphenyl)-2-methoxy-1H-imidazole?
The IUPAC name of 5-(5-chloro-4-methoxy-2-methylphenyl)-2-methoxy-1H-imidazole (CID 116883699) is 5-(5-chloro-4-methoxy-2-methylphenyl)-2-methoxy-1H-imidazole.
What is the SMILES notation for 5-(5-chloro-4-methoxy-2-methylphenyl)-2-methoxy-1H-imidazole?
The canonical SMILES for 5-(5-chloro-4-methoxy-2-methylphenyl)-2-methoxy-1H-imidazole is COc1ncc(-c2cc(Cl)c(OC)cc2C)[nH]1.
What is the InChIKey of 5-(5-chloro-4-methoxy-2-methylphenyl)-2-methoxy-1H-imidazole?
The InChIKey is QLDHIYJKWGFXNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13ClN2O2/c1-7-4-11(16-2)9(13)5-8(7)10-6-14-12(15-10)17-3/h4-6H,1-3H3,(H,14,15).
What are the key properties of 5-(5-chloro-4-methoxy-2-methylphenyl)-2-methoxy-1H-imidazole?
5-(5-chloro-4-methoxy-2-methylphenyl)-2-methoxy-1H-imidazole has a molecular weight of 252.70 g/mol, XLogP of 3.06, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-chloro-4-methoxy-2-methylphenyl)-2-methoxy-1H-imidazole is sourced from PubChem (CID 116883699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).