1-[1-[4-(4-methylphenyl)phenyl]propyl]imidazole

C19H20N2 — CID 44587320

IUPAC1-[1-[4-(4-methylphenyl)phenyl]propyl]imidazole
SMILESCCC(c1ccc(-c2ccc(C)cc2)cc1)n1ccnc1
InChIInChI=1S/C19H20N2/c1-3-19(21-13-12-20-14-21)18-10-8-17(9-11-18)16-6-4-15(2)5-7-16/h4-14,19H,3H2,1-2H3
InChIKeyACYNMPXDGVIZMP-UHFFFAOYSA-N
MW276.38 g/mol
LogP4.86
Rot. Bonds4

About 1-[1-[4-(4-methylphenyl)phenyl]propyl]imidazole

1-[1-[4-(4-methylphenyl)phenyl]propyl]imidazole (PubChem CID 44587320) has the molecular formula C19H20N2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 1-[1-[4-(4-methylphenyl)phenyl]propyl]imidazole.

Molecular Properties

Compound Name1-[1-[4-(4-methylphenyl)phenyl]propyl]imidazole
PubChem CID44587320
Molecular FormulaC19H20N2
Molecular Weight276.38 g/mol
Exact Mass276.16
IUPAC Name1-[1-[4-(4-methylphenyl)phenyl]propyl]imidazole
SMILESCCC(c1ccc(-c2ccc(C)cc2)cc1)n1ccnc1
InChIInChI=1S/C19H20N2/c1-3-19(21-13-12-20-14-21)18-10-8-17(9-11-18)16-6-4-15(2)5-7-16/h4-14,19H,3H2,1-2H3
InChIKeyACYNMPXDGVIZMP-UHFFFAOYSA-N
XLogP4.86
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 54.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[1-[4-(4-methylphenyl)phenyl]propyl]imidazole?
The IUPAC name of 1-[1-[4-(4-methylphenyl)phenyl]propyl]imidazole (CID 44587320) is 1-[1-[4-(4-methylphenyl)phenyl]propyl]imidazole.
What is the SMILES notation for 1-[1-[4-(4-methylphenyl)phenyl]propyl]imidazole?
The canonical SMILES for 1-[1-[4-(4-methylphenyl)phenyl]propyl]imidazole is CCC(c1ccc(-c2ccc(C)cc2)cc1)n1ccnc1.
What is the InChIKey of 1-[1-[4-(4-methylphenyl)phenyl]propyl]imidazole?
The InChIKey is ACYNMPXDGVIZMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2/c1-3-19(21-13-12-20-14-21)18-10-8-17(9-11-18)16-6-4-15(2)5-7-16/h4-14,19H,3H2,1-2H3.
What are the key properties of 1-[1-[4-(4-methylphenyl)phenyl]propyl]imidazole?
1-[1-[4-(4-methylphenyl)phenyl]propyl]imidazole has a molecular weight of 276.38 g/mol, XLogP of 4.86, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[4-(4-methylphenyl)phenyl]propyl]imidazole is sourced from PubChem (CID 44587320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).