1-[1-(4-phenylphenyl)pentyl]imidazole

C20H22N2 — CID 44587267

IUPAC1-[1-(4-phenylphenyl)pentyl]imidazole
SMILESCCCCC(c1ccc(-c2ccccc2)cc1)n1ccnc1
InChIInChI=1S/C20H22N2/c1-2-3-9-20(22-15-14-21-16-22)19-12-10-18(11-13-19)17-7-5-4-6-8-17/h4-8,10-16,20H,2-3,9H2,1H3
InChIKeyLJLOALSYDDARJF-UHFFFAOYSA-N
MW290.41 g/mol
LogP5.33
Rot. Bonds6

About 1-[1-(4-phenylphenyl)pentyl]imidazole

1-[1-(4-phenylphenyl)pentyl]imidazole (PubChem CID 44587267) has the molecular formula C20H22N2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 1-[1-(4-phenylphenyl)pentyl]imidazole.

Molecular Properties

Compound Name1-[1-(4-phenylphenyl)pentyl]imidazole
PubChem CID44587267
Molecular FormulaC20H22N2
Molecular Weight290.41 g/mol
Exact Mass290.18
IUPAC Name1-[1-(4-phenylphenyl)pentyl]imidazole
SMILESCCCCC(c1ccc(-c2ccccc2)cc1)n1ccnc1
InChIInChI=1S/C20H22N2/c1-2-3-9-20(22-15-14-21-16-22)19-12-10-18(11-13-19)17-7-5-4-6-8-17/h4-8,10-16,20H,2-3,9H2,1H3
InChIKeyLJLOALSYDDARJF-UHFFFAOYSA-N
XLogP5.33
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500290.41
LogP ≤ 55.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(4-phenylphenyl)pentyl]imidazole?
The IUPAC name of 1-[1-(4-phenylphenyl)pentyl]imidazole (CID 44587267) is 1-[1-(4-phenylphenyl)pentyl]imidazole.
What is the SMILES notation for 1-[1-(4-phenylphenyl)pentyl]imidazole?
The canonical SMILES for 1-[1-(4-phenylphenyl)pentyl]imidazole is CCCCC(c1ccc(-c2ccccc2)cc1)n1ccnc1.
What is the InChIKey of 1-[1-(4-phenylphenyl)pentyl]imidazole?
The InChIKey is LJLOALSYDDARJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2/c1-2-3-9-20(22-15-14-21-16-22)19-12-10-18(11-13-19)17-7-5-4-6-8-17/h4-8,10-16,20H,2-3,9H2,1H3.
What are the key properties of 1-[1-(4-phenylphenyl)pentyl]imidazole?
1-[1-(4-phenylphenyl)pentyl]imidazole has a molecular weight of 290.41 g/mol, XLogP of 5.33, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(4-phenylphenyl)pentyl]imidazole is sourced from PubChem (CID 44587267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).