2-(4-methylphenyl)-4-naphthalen-2-yl-5-phenyl-1H-imidazole;hydrochloride

C26H21ClN2 — CID 146051305

IUPAC2-(4-methylphenyl)-4-naphthalen-2-yl-5-phenyl-1H-imidazole;hydrochloride
SMILESCc1ccc(-c2nc(-c3ccc4ccccc4c3)c(-c3ccccc3)[nH]2)cc1.Cl
InChIInChI=1S/C26H20N2.ClH/c1-18-11-13-21(14-12-18)26-27-24(20-8-3-2-4-9-20)25(28-26)23-16-15-19-7-5-6-10-22(19)17-23;/h2-17H,1H3,(H,27,28);1H
InChIKeyAMPMMXOJMNJCMG-UHFFFAOYSA-N
MW396.92 g/mol
LogP7.29
Rot. Bonds3

About 2-(4-methylphenyl)-4-naphthalen-2-yl-5-phenyl-1H-imidazole;hydrochloride

2-(4-methylphenyl)-4-naphthalen-2-yl-5-phenyl-1H-imidazole;hydrochloride (PubChem CID 146051305) has the molecular formula C26H21ClN2 and a molecular weight of 396.92 g/mol. Its IUPAC name is 2-(4-methylphenyl)-4-naphthalen-2-yl-5-phenyl-1H-imidazole;hydrochloride.

Molecular Properties

Compound Name2-(4-methylphenyl)-4-naphthalen-2-yl-5-phenyl-1H-imidazole;hydrochloride
PubChem CID146051305
Molecular FormulaC26H21ClN2
Molecular Weight396.92 g/mol
Exact Mass396.14
IUPAC Name2-(4-methylphenyl)-4-naphthalen-2-yl-5-phenyl-1H-imidazole;hydrochloride
SMILESCc1ccc(-c2nc(-c3ccc4ccccc4c3)c(-c3ccccc3)[nH]2)cc1.Cl
InChIInChI=1S/C26H20N2.ClH/c1-18-11-13-21(14-12-18)26-27-24(20-8-3-2-4-9-20)25(28-26)23-16-15-19-7-5-6-10-22(19)17-23;/h2-17H,1H3,(H,27,28);1H
InChIKeyAMPMMXOJMNJCMG-UHFFFAOYSA-N
XLogP7.29
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500396.92
LogP ≤ 57.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imidazole_A(19)', 'substructure': 'N/A'}

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Related Compounds

5-(4-chlorophenyl)-2-naphthalen-2-yl-4-phenyl-1H-imidazole
CID 138455379
5-(4-bromophenyl)-2-(4-methylphenyl)-4-phenyl-1H-imidazole
CID 3106859
4-phenyl-2,5-bis(4-phenylphenyl)-1H-imidazole
CID 134113623
5-[4-[4-(2,4-diphenyl-1H-imidazol-5-yl)phenyl]phenyl]-2,4-diphenyl-1H-imidazole
CID 3106607
[4-[2-(4-methylphenyl)-4-phenyl-1H-imidazol-5-yl]phenyl]-[4-[2-(4-methylphenyl)-5-phenyl-1H-imidazol-4-yl]phenyl]methanone
CID 135438613
4-(4-methoxyphenyl)-2-[4-[4-(4-methoxyphenyl)-5-phenyl-1H-imidazol-2-yl]phenyl]-5-phenyl-1H-imidazole
CID 136591177
2-(8-methylnaphthalen-2-yl)-4,5-diphenyl-1H-imidazole
CID 139797871
[4-[2-(4-methylphenyl)-4-phenyl-1H-imidazol-5-yl]phenyl]-phenylmethanone
CID 2259189
4,5-bis[4-(4-methoxyphenyl)phenyl]-2-phenyl-1H-imidazole
CID 86068927
2-[4-[6-[3-[4-[4,5-bis(4-methylphenyl)-1H-imidazol-2-yl]phenyl]-2-methyl-1-benzothiophen-6-yl]anthracen-2-yl]phenyl]-4,5-diphenyl-1H-imidazole
CID 59012346
4,5-bis(4-methoxyphenyl)-2-(4-methylphenyl)-1H-imidazole
CID 1101727
4,5-bis(4-methylphenyl)-2-(3-propan-2-ylphenyl)-1H-imidazole
CID 59910776

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenyl)-4-naphthalen-2-yl-5-phenyl-1H-imidazole;hydrochloride?
The IUPAC name of 2-(4-methylphenyl)-4-naphthalen-2-yl-5-phenyl-1H-imidazole;hydrochloride (CID 146051305) is 2-(4-methylphenyl)-4-naphthalen-2-yl-5-phenyl-1H-imidazole;hydrochloride.
What is the SMILES notation for 2-(4-methylphenyl)-4-naphthalen-2-yl-5-phenyl-1H-imidazole;hydrochloride?
The canonical SMILES for 2-(4-methylphenyl)-4-naphthalen-2-yl-5-phenyl-1H-imidazole;hydrochloride is Cc1ccc(-c2nc(-c3ccc4ccccc4c3)c(-c3ccccc3)[nH]2)cc1.Cl.
What is the InChIKey of 2-(4-methylphenyl)-4-naphthalen-2-yl-5-phenyl-1H-imidazole;hydrochloride?
The InChIKey is AMPMMXOJMNJCMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H20N2.ClH/c1-18-11-13-21(14-12-18)26-27-24(20-8-3-2-4-9-20)25(28-26)23-16-15-19-7-5-6-10-22(19)17-23;/h2-17H,1H3,(H,27,28);1H.
What are the key properties of 2-(4-methylphenyl)-4-naphthalen-2-yl-5-phenyl-1H-imidazole;hydrochloride?
2-(4-methylphenyl)-4-naphthalen-2-yl-5-phenyl-1H-imidazole;hydrochloride has a molecular weight of 396.92 g/mol, XLogP of 7.29, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylphenyl)-4-naphthalen-2-yl-5-phenyl-1H-imidazole;hydrochloride is sourced from PubChem (CID 146051305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).