1-[1-(1H-benzimidazol-2-yl)pentyl]-2-phenylbenzimidazole

C25H24N4 — CID 51361226

IUPAC1-[1-(1H-benzimidazol-2-yl)pentyl]-2-phenylbenzimidazole
SMILESCCCCC(c1nc2ccccc2[nH]1)n1c(-c2ccccc2)nc2ccccc21
InChIInChI=1S/C25H24N4/c1-2-3-16-23(24-26-19-13-7-8-14-20(19)27-24)29-22-17-10-9-15-21(22)28-25(29)18-11-5-4-6-12-18/h4-15,17,23H,2-3,16H2,1H3,(H,26,27)
InChIKeyDEYKTZIHMRISTJ-UHFFFAOYSA-N
MW380.50 g/mol
LogP6.36
Rot. Bonds6

About 1-[1-(1H-benzimidazol-2-yl)pentyl]-2-phenylbenzimidazole

1-[1-(1H-benzimidazol-2-yl)pentyl]-2-phenylbenzimidazole (PubChem CID 51361226) has the molecular formula C25H24N4 and a molecular weight of 380.50 g/mol. Its IUPAC name is 1-[1-(1H-benzimidazol-2-yl)pentyl]-2-phenylbenzimidazole.

Molecular Properties

Compound Name1-[1-(1H-benzimidazol-2-yl)pentyl]-2-phenylbenzimidazole
PubChem CID51361226
Molecular FormulaC25H24N4
Molecular Weight380.50 g/mol
Exact Mass380.20
IUPAC Name1-[1-(1H-benzimidazol-2-yl)pentyl]-2-phenylbenzimidazole
SMILESCCCCC(c1nc2ccccc2[nH]1)n1c(-c2ccccc2)nc2ccccc21
InChIInChI=1S/C25H24N4/c1-2-3-16-23(24-26-19-13-7-8-14-20(19)27-24)29-22-17-10-9-15-21(22)28-25(29)18-11-5-4-6-12-18/h4-15,17,23H,2-3,16H2,1H3,(H,26,27)
InChIKeyDEYKTZIHMRISTJ-UHFFFAOYSA-N
XLogP6.36
TPSA46.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500380.50
LogP ≤ 56.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[1-(1H-benzimidazol-2-yl)pentyl]-2-phenylbenzimidazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[1-(1H-benzimidazol-2-yl)pentyl]-2-phenylbenzimidazole?
The IUPAC name of 1-[1-(1H-benzimidazol-2-yl)pentyl]-2-phenylbenzimidazole (CID 51361226) is 1-[1-(1H-benzimidazol-2-yl)pentyl]-2-phenylbenzimidazole.
What is the SMILES notation for 1-[1-(1H-benzimidazol-2-yl)pentyl]-2-phenylbenzimidazole?
The canonical SMILES for 1-[1-(1H-benzimidazol-2-yl)pentyl]-2-phenylbenzimidazole is CCCCC(c1nc2ccccc2[nH]1)n1c(-c2ccccc2)nc2ccccc21.
What is the InChIKey of 1-[1-(1H-benzimidazol-2-yl)pentyl]-2-phenylbenzimidazole?
The InChIKey is DEYKTZIHMRISTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N4/c1-2-3-16-23(24-26-19-13-7-8-14-20(19)27-24)29-22-17-10-9-15-21(22)28-25(29)18-11-5-4-6-12-18/h4-15,17,23H,2-3,16H2,1H3,(H,26,27).
What are the key properties of 1-[1-(1H-benzimidazol-2-yl)pentyl]-2-phenylbenzimidazole?
1-[1-(1H-benzimidazol-2-yl)pentyl]-2-phenylbenzimidazole has a molecular weight of 380.50 g/mol, XLogP of 6.36, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(1H-benzimidazol-2-yl)pentyl]-2-phenylbenzimidazole is sourced from PubChem (CID 51361226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).