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

C11H10Cl2N2O — CID 116884397

IUPAC2-chloro-5-(5-chloro-4-methoxy-2-methylphenyl)-1H-imidazole
SMILESCOc1cc(C)c(-c2cnc(Cl)[nH]2)cc1Cl
InChIInChI=1S/C11H10Cl2N2O/c1-6-3-10(16-2)8(12)4-7(6)9-5-14-11(13)15-9/h3-5H,1-2H3,(H,14,15)
InChIKeyVMGZSTCVQKQCOA-UHFFFAOYSA-N
MW257.12 g/mol
LogP3.70
Rot. Bonds2

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

2-chloro-5-(5-chloro-4-methoxy-2-methylphenyl)-1H-imidazole (PubChem CID 116884397) has the molecular formula C11H10Cl2N2O and a molecular weight of 257.12 g/mol. Its IUPAC name is 2-chloro-5-(5-chloro-4-methoxy-2-methylphenyl)-1H-imidazole.

Molecular Properties

Compound Name2-chloro-5-(5-chloro-4-methoxy-2-methylphenyl)-1H-imidazole
PubChem CID116884397
Molecular FormulaC11H10Cl2N2O
Molecular Weight257.12 g/mol
Exact Mass256.02
IUPAC Name2-chloro-5-(5-chloro-4-methoxy-2-methylphenyl)-1H-imidazole
SMILESCOc1cc(C)c(-c2cnc(Cl)[nH]2)cc1Cl
InChIInChI=1S/C11H10Cl2N2O/c1-6-3-10(16-2)8(12)4-7(6)9-5-14-11(13)15-9/h3-5H,1-2H3,(H,14,15)
InChIKeyVMGZSTCVQKQCOA-UHFFFAOYSA-N
XLogP3.70
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.12
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-(5-chloro-4-methoxy-2-methylphenyl)-2-methoxy-1H-imidazole
CID 116883699
[5-(5-chloro-4-ethoxy-2-methylphenyl)-1H-imidazol-2-yl]methanamine
CID 82304282
2-[5-(5-chloro-2-methoxy-4-methylphenyl)-1H-imidazol-2-yl]ethanamine
CID 82304273
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
2-chloro-5-(2-methoxy-4-propan-2-ylphenyl)-1H-imidazole
CID 116884410
1-[5-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-1H-imidazol-2-yl]-N-methylmethanamine
CID 95475764
5-(5-tert-butyl-2-methylphenyl)-2-chloro-1H-imidazole
CID 116884375
2-chloro-5-(2-methylphenyl)-1H-imidazole
CID 105446616
2-bromo-5-(2-methoxy-4,5-dimethylphenyl)-1H-imidazole
CID 116884250
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

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-(5-chloro-4-methoxy-2-methylphenyl)-1H-imidazole?
The IUPAC name of 2-chloro-5-(5-chloro-4-methoxy-2-methylphenyl)-1H-imidazole (CID 116884397) is 2-chloro-5-(5-chloro-4-methoxy-2-methylphenyl)-1H-imidazole.
What is the SMILES notation for 2-chloro-5-(5-chloro-4-methoxy-2-methylphenyl)-1H-imidazole?
The canonical SMILES for 2-chloro-5-(5-chloro-4-methoxy-2-methylphenyl)-1H-imidazole is COc1cc(C)c(-c2cnc(Cl)[nH]2)cc1Cl.
What is the InChIKey of 2-chloro-5-(5-chloro-4-methoxy-2-methylphenyl)-1H-imidazole?
The InChIKey is VMGZSTCVQKQCOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10Cl2N2O/c1-6-3-10(16-2)8(12)4-7(6)9-5-14-11(13)15-9/h3-5H,1-2H3,(H,14,15).
What are the key properties of 2-chloro-5-(5-chloro-4-methoxy-2-methylphenyl)-1H-imidazole?
2-chloro-5-(5-chloro-4-methoxy-2-methylphenyl)-1H-imidazole has a molecular weight of 257.12 g/mol, XLogP of 3.70, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-(5-chloro-4-methoxy-2-methylphenyl)-1H-imidazole is sourced from PubChem (CID 116884397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).