2-(8-methylnaphthalen-2-yl)-4,5-diphenyl-1H-imidazole

C26H20N2 — CID 139797871

IUPAC2-(8-methylnaphthalen-2-yl)-4,5-diphenyl-1H-imidazole
SMILESCc1cccc2ccc(-c3nc(-c4ccccc4)c(-c4ccccc4)[nH]3)cc12
InChIInChI=1S/C26H20N2/c1-18-9-8-14-19-15-16-22(17-23(18)19)26-27-24(20-10-4-2-5-11-20)25(28-26)21-12-6-3-7-13-21/h2-17H,1H3,(H,27,28)
InChIKeyNRSKVVRQSBWZOD-UHFFFAOYSA-N
MW360.46 g/mol
LogP6.87
Rot. Bonds3

About 2-(8-methylnaphthalen-2-yl)-4,5-diphenyl-1H-imidazole

2-(8-methylnaphthalen-2-yl)-4,5-diphenyl-1H-imidazole (PubChem CID 139797871) has the molecular formula C26H20N2 and a molecular weight of 360.46 g/mol. Its IUPAC name is 2-(8-methylnaphthalen-2-yl)-4,5-diphenyl-1H-imidazole.

Molecular Properties

Compound Name2-(8-methylnaphthalen-2-yl)-4,5-diphenyl-1H-imidazole
PubChem CID139797871
Molecular FormulaC26H20N2
Molecular Weight360.46 g/mol
Exact Mass360.16
IUPAC Name2-(8-methylnaphthalen-2-yl)-4,5-diphenyl-1H-imidazole
SMILESCc1cccc2ccc(-c3nc(-c4ccccc4)c(-c4ccccc4)[nH]3)cc12
InChIInChI=1S/C26H20N2/c1-18-9-8-14-19-15-16-22(17-23(18)19)26-27-24(20-10-4-2-5-11-20)25(28-26)21-12-6-3-7-13-21/h2-17H,1H3,(H,27,28)
InChIKeyNRSKVVRQSBWZOD-UHFFFAOYSA-N
XLogP6.87
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.46
LogP ≤ 56.87
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

2-(3-iodophenyl)-4-[4-[2-(3-iodophenyl)-4-phenyl-1H-imidazol-5-yl]phenyl]-5-phenyl-1H-imidazole
CID 135398995
5-[4-[4-(2,4-diphenyl-1H-imidazol-5-yl)phenyl]phenyl]-2,4-diphenyl-1H-imidazole
CID 3106607
4-phenyl-2,5-bis(4-phenylphenyl)-1H-imidazole
CID 134113623
2-(4-methylphenyl)-4-naphthalen-2-yl-5-phenyl-1H-imidazole;hydrochloride
CID 146051305
5-(4-chlorophenyl)-2-naphthalen-2-yl-4-phenyl-1H-imidazole
CID 138455379
2-[4-[2-(2-methylphenyl)ethynyl]phenyl]-4,5-diphenyl-1H-imidazole
CID 177421589
4-(3,4-dimethylphenyl)-2-(3-methoxyphenyl)-5-phenyl-1H-imidazole
CID 1110224
5-(4-bromophenyl)-2-(4-methylphenyl)-4-phenyl-1H-imidazole
CID 3106859
4,5-bis(4-methylphenyl)-2-(3-propan-2-ylphenyl)-1H-imidazole
CID 59910776
4-(4-methoxyphenyl)-2-[4-[4-(4-methoxyphenyl)-5-phenyl-1H-imidazol-2-yl]phenyl]-5-phenyl-1H-imidazole
CID 136591177
2-[2-bromo-4-(4,5-diphenyl-1H-imidazol-2-yl)phenyl]-4,5-diphenyl-1H-imidazole
CID 146679981
4-[5-[4-[2-[4-(dimethylamino)phenyl]-4-phenyl-1H-imidazol-5-yl]phenyl]-4-phenyl-1H-imidazol-2-yl]-N,N-dimethylaniline
CID 3106619

Frequently Asked Questions

What is the IUPAC name of 2-(8-methylnaphthalen-2-yl)-4,5-diphenyl-1H-imidazole?
The IUPAC name of 2-(8-methylnaphthalen-2-yl)-4,5-diphenyl-1H-imidazole (CID 139797871) is 2-(8-methylnaphthalen-2-yl)-4,5-diphenyl-1H-imidazole.
What is the SMILES notation for 2-(8-methylnaphthalen-2-yl)-4,5-diphenyl-1H-imidazole?
The canonical SMILES for 2-(8-methylnaphthalen-2-yl)-4,5-diphenyl-1H-imidazole is Cc1cccc2ccc(-c3nc(-c4ccccc4)c(-c4ccccc4)[nH]3)cc12.
What is the InChIKey of 2-(8-methylnaphthalen-2-yl)-4,5-diphenyl-1H-imidazole?
The InChIKey is NRSKVVRQSBWZOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H20N2/c1-18-9-8-14-19-15-16-22(17-23(18)19)26-27-24(20-10-4-2-5-11-20)25(28-26)21-12-6-3-7-13-21/h2-17H,1H3,(H,27,28).
What are the key properties of 2-(8-methylnaphthalen-2-yl)-4,5-diphenyl-1H-imidazole?
2-(8-methylnaphthalen-2-yl)-4,5-diphenyl-1H-imidazole has a molecular weight of 360.46 g/mol, XLogP of 6.87, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-methylnaphthalen-2-yl)-4,5-diphenyl-1H-imidazole is sourced from PubChem (CID 139797871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).