azane;1,2,4-tribenzyl-4,5-dihydroimidazole

C24H27N3 — CID 175325787

IUPACazane;1,2,4-tribenzyl-4,5-dihydroimidazole
SMILESN.c1ccc(CC2=NC(Cc3ccccc3)CN2Cc2ccccc2)cc1
InChIInChI=1S/C24H24N2.H3N/c1-4-10-20(11-5-1)16-23-19-26(18-22-14-8-3-9-15-22)24(25-23)17-21-12-6-2-7-13-21;/h1-15,23H,16-19H2;1H3
InChIKeyVEGFUZFPDYOKEF-UHFFFAOYSA-N
MW357.50 g/mol
LogP4.92
Rot. Bonds6

About azane;1,2,4-tribenzyl-4,5-dihydroimidazole

azane;1,2,4-tribenzyl-4,5-dihydroimidazole (PubChem CID 175325787) has the molecular formula C24H27N3 and a molecular weight of 357.50 g/mol. Its IUPAC name is azane;1,2,4-tribenzyl-4,5-dihydroimidazole.

Molecular Properties

Compound Nameazane;1,2,4-tribenzyl-4,5-dihydroimidazole
PubChem CID175325787
Molecular FormulaC24H27N3
Molecular Weight357.50 g/mol
Exact Mass357.22
IUPAC Nameazane;1,2,4-tribenzyl-4,5-dihydroimidazole
SMILESN.c1ccc(CC2=NC(Cc3ccccc3)CN2Cc2ccccc2)cc1
InChIInChI=1S/C24H24N2.H3N/c1-4-10-20(11-5-1)16-23-19-26(18-22-14-8-3-9-15-22)24(25-23)17-21-12-6-2-7-13-21;/h1-15,23H,16-19H2;1H3
InChIKeyVEGFUZFPDYOKEF-UHFFFAOYSA-N
XLogP4.92
TPSA50.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.50
LogP ≤ 54.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of azane;1,2,4-tribenzyl-4,5-dihydroimidazole?
The IUPAC name of azane;1,2,4-tribenzyl-4,5-dihydroimidazole (CID 175325787) is azane;1,2,4-tribenzyl-4,5-dihydroimidazole.
What is the SMILES notation for azane;1,2,4-tribenzyl-4,5-dihydroimidazole?
The canonical SMILES for azane;1,2,4-tribenzyl-4,5-dihydroimidazole is N.c1ccc(CC2=NC(Cc3ccccc3)CN2Cc2ccccc2)cc1.
What is the InChIKey of azane;1,2,4-tribenzyl-4,5-dihydroimidazole?
The InChIKey is VEGFUZFPDYOKEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2.H3N/c1-4-10-20(11-5-1)16-23-19-26(18-22-14-8-3-9-15-22)24(25-23)17-21-12-6-2-7-13-21;/h1-15,23H,16-19H2;1H3.
What are the key properties of azane;1,2,4-tribenzyl-4,5-dihydroimidazole?
azane;1,2,4-tribenzyl-4,5-dihydroimidazole has a molecular weight of 357.50 g/mol, XLogP of 4.92, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for azane;1,2,4-tribenzyl-4,5-dihydroimidazole is sourced from PubChem (CID 175325787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).