1-(2-chlorophenyl)-4-(3,5-dimethylphenyl)imidazole

C17H15ClN2 — CID 174900546

IUPAC1-(2-chlorophenyl)-4-(3,5-dimethylphenyl)imidazole
SMILESCc1cc(C)cc(-c2cn(-c3ccccc3Cl)cn2)c1
InChIInChI=1S/C17H15ClN2/c1-12-7-13(2)9-14(8-12)16-10-20(11-19-16)17-6-4-3-5-15(17)18/h3-11H,1-2H3
InChIKeyQHHIWRVLEDQJEP-UHFFFAOYSA-N
MW282.77 g/mol
LogP4.81
Rot. Bonds2

About 1-(2-chlorophenyl)-4-(3,5-dimethylphenyl)imidazole

1-(2-chlorophenyl)-4-(3,5-dimethylphenyl)imidazole (PubChem CID 174900546) has the molecular formula C17H15ClN2 and a molecular weight of 282.77 g/mol. Its IUPAC name is 1-(2-chlorophenyl)-4-(3,5-dimethylphenyl)imidazole.

Molecular Properties

Compound Name1-(2-chlorophenyl)-4-(3,5-dimethylphenyl)imidazole
PubChem CID174900546
Molecular FormulaC17H15ClN2
Molecular Weight282.77 g/mol
Exact Mass282.09
IUPAC Name1-(2-chlorophenyl)-4-(3,5-dimethylphenyl)imidazole
SMILESCc1cc(C)cc(-c2cn(-c3ccccc3Cl)cn2)c1
InChIInChI=1S/C17H15ClN2/c1-12-7-13(2)9-14(8-12)16-10-20(11-19-16)17-6-4-3-5-15(17)18/h3-11H,1-2H3
InChIKeyQHHIWRVLEDQJEP-UHFFFAOYSA-N
XLogP4.81
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.77
LogP ≤ 54.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenyl)-4-(3,5-dimethylphenyl)imidazole?
The IUPAC name of 1-(2-chlorophenyl)-4-(3,5-dimethylphenyl)imidazole (CID 174900546) is 1-(2-chlorophenyl)-4-(3,5-dimethylphenyl)imidazole.
What is the SMILES notation for 1-(2-chlorophenyl)-4-(3,5-dimethylphenyl)imidazole?
The canonical SMILES for 1-(2-chlorophenyl)-4-(3,5-dimethylphenyl)imidazole is Cc1cc(C)cc(-c2cn(-c3ccccc3Cl)cn2)c1.
What is the InChIKey of 1-(2-chlorophenyl)-4-(3,5-dimethylphenyl)imidazole?
The InChIKey is QHHIWRVLEDQJEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15ClN2/c1-12-7-13(2)9-14(8-12)16-10-20(11-19-16)17-6-4-3-5-15(17)18/h3-11H,1-2H3.
What are the key properties of 1-(2-chlorophenyl)-4-(3,5-dimethylphenyl)imidazole?
1-(2-chlorophenyl)-4-(3,5-dimethylphenyl)imidazole has a molecular weight of 282.77 g/mol, XLogP of 4.81, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorophenyl)-4-(3,5-dimethylphenyl)imidazole is sourced from PubChem (CID 174900546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).