2-(2,3-dimethylphenyl)-1H-imidazole

C11H12N2 — CID 12622726

IUPAC2-(2,3-dimethylphenyl)-1H-imidazole
SMILESCc1cccc(-c2ncc[nH]2)c1C
InChIInChI=1S/C11H12N2/c1-8-4-3-5-10(9(8)2)11-12-6-7-13-11/h3-7H,1-2H3,(H,12,13)
InChIKeyNXUCETYUQFSJBO-UHFFFAOYSA-N
MW172.23 g/mol
LogP2.69
Rot. Bonds1

About 2-(2,3-dimethylphenyl)-1H-imidazole

2-(2,3-dimethylphenyl)-1H-imidazole (PubChem CID 12622726) has the molecular formula C11H12N2 and a molecular weight of 172.23 g/mol. Its IUPAC name is 2-(2,3-dimethylphenyl)-1H-imidazole.

Molecular Properties

Compound Name2-(2,3-dimethylphenyl)-1H-imidazole
PubChem CID12622726
Molecular FormulaC11H12N2
Molecular Weight172.23 g/mol
Exact Mass172.10
IUPAC Name2-(2,3-dimethylphenyl)-1H-imidazole
SMILESCc1cccc(-c2ncc[nH]2)c1C
InChIInChI=1S/C11H12N2/c1-8-4-3-5-10(9(8)2)11-12-6-7-13-11/h3-7H,1-2H3,(H,12,13)
InChIKeyNXUCETYUQFSJBO-UHFFFAOYSA-N
XLogP2.69
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dimethylphenyl)-1H-imidazole?
The IUPAC name of 2-(2,3-dimethylphenyl)-1H-imidazole (CID 12622726) is 2-(2,3-dimethylphenyl)-1H-imidazole.
What is the SMILES notation for 2-(2,3-dimethylphenyl)-1H-imidazole?
The canonical SMILES for 2-(2,3-dimethylphenyl)-1H-imidazole is Cc1cccc(-c2ncc[nH]2)c1C.
What is the InChIKey of 2-(2,3-dimethylphenyl)-1H-imidazole?
The InChIKey is NXUCETYUQFSJBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2/c1-8-4-3-5-10(9(8)2)11-12-6-7-13-11/h3-7H,1-2H3,(H,12,13).
What are the key properties of 2-(2,3-dimethylphenyl)-1H-imidazole?
2-(2,3-dimethylphenyl)-1H-imidazole has a molecular weight of 172.23 g/mol, XLogP of 2.69, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dimethylphenyl)-1H-imidazole is sourced from PubChem (CID 12622726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).