1-[imidazol-1-yl(diphenyl)methyl]imidazole

C19H16N4 — CID 3007433

IUPAC1-[imidazol-1-yl(diphenyl)methyl]imidazole
SMILESc1ccc(C(c2ccccc2)(n2ccnc2)n2ccnc2)cc1
InChIInChI=1S/C19H16N4/c1-3-7-17(8-4-1)19(22-13-11-20-15-22,23-14-12-21-16-23)18-9-5-2-6-10-18/h1-16H
InChIKeyAUGBLNBLUKUREA-UHFFFAOYSA-N
MW300.37 g/mol
LogP3.38
Rot. Bonds4

About 1-[imidazol-1-yl(diphenyl)methyl]imidazole

1-[imidazol-1-yl(diphenyl)methyl]imidazole (PubChem CID 3007433) has the molecular formula C19H16N4 and a molecular weight of 300.37 g/mol. Its IUPAC name is 1-[imidazol-1-yl(diphenyl)methyl]imidazole.

Molecular Properties

Compound Name1-[imidazol-1-yl(diphenyl)methyl]imidazole
PubChem CID3007433
Molecular FormulaC19H16N4
Molecular Weight300.37 g/mol
Exact Mass300.14
IUPAC Name1-[imidazol-1-yl(diphenyl)methyl]imidazole
SMILESc1ccc(C(c2ccccc2)(n2ccnc2)n2ccnc2)cc1
InChIInChI=1S/C19H16N4/c1-3-7-17(8-4-1)19(22-13-11-20-15-22,23-14-12-21-16-23)18-9-5-2-6-10-18/h1-16H
InChIKeyAUGBLNBLUKUREA-UHFFFAOYSA-N
XLogP3.38
TPSA35.64 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.37
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[imidazol-1-yl(diphenyl)methyl]imidazole?
The IUPAC name of 1-[imidazol-1-yl(diphenyl)methyl]imidazole (CID 3007433) is 1-[imidazol-1-yl(diphenyl)methyl]imidazole.
What is the SMILES notation for 1-[imidazol-1-yl(diphenyl)methyl]imidazole?
The canonical SMILES for 1-[imidazol-1-yl(diphenyl)methyl]imidazole is c1ccc(C(c2ccccc2)(n2ccnc2)n2ccnc2)cc1.
What is the InChIKey of 1-[imidazol-1-yl(diphenyl)methyl]imidazole?
The InChIKey is AUGBLNBLUKUREA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N4/c1-3-7-17(8-4-1)19(22-13-11-20-15-22,23-14-12-21-16-23)18-9-5-2-6-10-18/h1-16H.
What are the key properties of 1-[imidazol-1-yl(diphenyl)methyl]imidazole?
1-[imidazol-1-yl(diphenyl)methyl]imidazole has a molecular weight of 300.37 g/mol, XLogP of 3.38, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[imidazol-1-yl(diphenyl)methyl]imidazole is sourced from PubChem (CID 3007433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).