5-[bis(2-methylphenyl)methyl]-1H-imidazole

C18H18N2 — CID 13071795

IUPAC5-[bis(2-methylphenyl)methyl]-1H-imidazole
SMILESCc1ccccc1C(c1cnc[nH]1)c1ccccc1C
InChIInChI=1S/C18H18N2/c1-13-7-3-5-9-15(13)18(17-11-19-12-20-17)16-10-6-4-8-14(16)2/h3-12,18H,1-2H3,(H,19,20)
InChIKeyQIEGPJPVEKTLAQ-UHFFFAOYSA-N
MW262.36 g/mol
LogP4.21
Rot. Bonds3

About 5-[bis(2-methylphenyl)methyl]-1H-imidazole

5-[bis(2-methylphenyl)methyl]-1H-imidazole (PubChem CID 13071795) has the molecular formula C18H18N2 and a molecular weight of 262.36 g/mol. Its IUPAC name is 5-[bis(2-methylphenyl)methyl]-1H-imidazole.

Molecular Properties

Compound Name5-[bis(2-methylphenyl)methyl]-1H-imidazole
PubChem CID13071795
Molecular FormulaC18H18N2
Molecular Weight262.36 g/mol
Exact Mass262.15
IUPAC Name5-[bis(2-methylphenyl)methyl]-1H-imidazole
SMILESCc1ccccc1C(c1cnc[nH]1)c1ccccc1C
InChIInChI=1S/C18H18N2/c1-13-7-3-5-9-15(13)18(17-11-19-12-20-17)16-10-6-4-8-14(16)2/h3-12,18H,1-2H3,(H,19,20)
InChIKeyQIEGPJPVEKTLAQ-UHFFFAOYSA-N
XLogP4.21
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-[(1S)-1,2,2,2-tetradeuterio-1-(2,3-dimethylphenyl)ethyl]-1H-imidazole
CID 169437868
5-[(1S)-1-(2,3-dimethylphenyl)ethyl]-1H-imidazole;formic acid
CID 155150082
N-[3-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]-2-fluorophenyl]methanesulfonamide
CID 176560035
5-[(2-chlorophenyl)-(4-chlorophenyl)methyl]-1H-imidazole
CID 70163834
5-[3,3-bis(2-methylphenyl)propyl]-1H-imidazole;hydrochloride
CID 14535975
4-[(2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine
CID 25121755
4-[(3-chloro-2-methylphenyl)-(1H-imidazol-5-yl)methyl]pyridine
CID 25121395
2-[1-(1H-imidazol-5-yl)ethyl]benzonitrile
CID 55254692
5-[1-(2,3-dimethylphenyl)-2-(3,4-dimethylphenyl)ethyl]-1H-imidazole
CID 177218655
ethane;5-(1-phenylethyl)-1H-imidazole
CID 123176556
5-[(1R)-1-(2,4-dimethylphenyl)ethyl]-1H-imidazole
CID 171381974
1H-imidazol-5-yl(naphthalen-1-yl)methanol
CID 10376336

Frequently Asked Questions

What is the IUPAC name of 5-[bis(2-methylphenyl)methyl]-1H-imidazole?
The IUPAC name of 5-[bis(2-methylphenyl)methyl]-1H-imidazole (CID 13071795) is 5-[bis(2-methylphenyl)methyl]-1H-imidazole.
What is the SMILES notation for 5-[bis(2-methylphenyl)methyl]-1H-imidazole?
The canonical SMILES for 5-[bis(2-methylphenyl)methyl]-1H-imidazole is Cc1ccccc1C(c1cnc[nH]1)c1ccccc1C.
What is the InChIKey of 5-[bis(2-methylphenyl)methyl]-1H-imidazole?
The InChIKey is QIEGPJPVEKTLAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2/c1-13-7-3-5-9-15(13)18(17-11-19-12-20-17)16-10-6-4-8-14(16)2/h3-12,18H,1-2H3,(H,19,20).
What are the key properties of 5-[bis(2-methylphenyl)methyl]-1H-imidazole?
5-[bis(2-methylphenyl)methyl]-1H-imidazole has a molecular weight of 262.36 g/mol, XLogP of 4.21, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[bis(2-methylphenyl)methyl]-1H-imidazole is sourced from PubChem (CID 13071795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).