5-(2,3-dimethoxyphenyl)-2-phenyl-1H-imidazole;hydrochloride

C17H17ClN2O2 — CID 56926255

IUPAC5-(2,3-dimethoxyphenyl)-2-phenyl-1H-imidazole;hydrochloride
SMILESCOc1cccc(-c2cnc(-c3ccccc3)[nH]2)c1OC.Cl
InChIInChI=1S/C17H16N2O2.ClH/c1-20-15-10-6-9-13(16(15)21-2)14-11-18-17(19-14)12-7-4-3-5-8-12;/h3-11H,1-2H3,(H,18,19);1H
InChIKeyJWGRBWFMQLZLMK-UHFFFAOYSA-N
MW316.79 g/mol
LogP4.18
Rot. Bonds4

About 5-(2,3-dimethoxyphenyl)-2-phenyl-1H-imidazole;hydrochloride

5-(2,3-dimethoxyphenyl)-2-phenyl-1H-imidazole;hydrochloride (PubChem CID 56926255) has the molecular formula C17H17ClN2O2 and a molecular weight of 316.79 g/mol. Its IUPAC name is 5-(2,3-dimethoxyphenyl)-2-phenyl-1H-imidazole;hydrochloride.

Molecular Properties

Compound Name5-(2,3-dimethoxyphenyl)-2-phenyl-1H-imidazole;hydrochloride
PubChem CID56926255
Molecular FormulaC17H17ClN2O2
Molecular Weight316.79 g/mol
Exact Mass316.10
IUPAC Name5-(2,3-dimethoxyphenyl)-2-phenyl-1H-imidazole;hydrochloride
SMILESCOc1cccc(-c2cnc(-c3ccccc3)[nH]2)c1OC.Cl
InChIInChI=1S/C17H16N2O2.ClH/c1-20-15-10-6-9-13(16(15)21-2)14-11-18-17(19-14)12-7-4-3-5-8-12;/h3-11H,1-2H3,(H,18,19);1H
InChIKeyJWGRBWFMQLZLMK-UHFFFAOYSA-N
XLogP4.18
TPSA47.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.79
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-[2,4-dimethoxy-5-(2-phenyl-1H-imidazol-5-yl)phenyl]-2-phenyl-1H-imidazole;ethane
CID 144664687
3-[5-(2-methoxyphenyl)-1H-imidazol-2-yl]pyridine
CID 99963134
5-(2-methoxy-4-phenylmethoxyphenyl)-2-phenyl-1H-imidazole;hydrochloride
CID 158418618
2-(4-chlorophenyl)-5-(2-methoxy-4-phenylmethoxyphenyl)-1H-imidazole
CID 58510130
3-(2,3-dimethoxyphenyl)pyridine
CID 22001178
4-[2-(4-fluorophenyl)-1H-imidazol-5-yl]-3-methoxyphenol
CID 70667347
1-methoxy-3-phenyl-2-phenylmethoxybenzene
CID 11994921
5-(2-methoxy-4-phenylmethoxyphenyl)-2-[4-(trifluoromethyl)phenyl]-1H-imidazole
CID 58510131
[2-[2-[3-[5-(2-ethoxycarbonyloxyphenyl)-1H-imidazol-2-yl]phenyl]-1H-imidazol-5-yl]phenyl] ethyl carbonate
CID 118529877
4-[2-(2,3-dimethoxyphenyl)-1H-imidazol-5-yl]piperidine
CID 82463609
2-(4-fluorophenyl)-5-(4-methoxyphenyl)-1H-imidazole;hydrochloride
CID 18673126
2-(2-chloroethyl)-5-(2-methoxyphenyl)-1H-imidazole
CID 116878237

Frequently Asked Questions

What is the IUPAC name of 5-(2,3-dimethoxyphenyl)-2-phenyl-1H-imidazole;hydrochloride?
The IUPAC name of 5-(2,3-dimethoxyphenyl)-2-phenyl-1H-imidazole;hydrochloride (CID 56926255) is 5-(2,3-dimethoxyphenyl)-2-phenyl-1H-imidazole;hydrochloride.
What is the SMILES notation for 5-(2,3-dimethoxyphenyl)-2-phenyl-1H-imidazole;hydrochloride?
The canonical SMILES for 5-(2,3-dimethoxyphenyl)-2-phenyl-1H-imidazole;hydrochloride is COc1cccc(-c2cnc(-c3ccccc3)[nH]2)c1OC.Cl.
What is the InChIKey of 5-(2,3-dimethoxyphenyl)-2-phenyl-1H-imidazole;hydrochloride?
The InChIKey is JWGRBWFMQLZLMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O2.ClH/c1-20-15-10-6-9-13(16(15)21-2)14-11-18-17(19-14)12-7-4-3-5-8-12;/h3-11H,1-2H3,(H,18,19);1H.
What are the key properties of 5-(2,3-dimethoxyphenyl)-2-phenyl-1H-imidazole;hydrochloride?
5-(2,3-dimethoxyphenyl)-2-phenyl-1H-imidazole;hydrochloride has a molecular weight of 316.79 g/mol, XLogP of 4.18, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,3-dimethoxyphenyl)-2-phenyl-1H-imidazole;hydrochloride is sourced from PubChem (CID 56926255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).