6-fluoro-2-(4-phenyl-2-pyridinyl)-1H-benzimidazole

C18H12FN3 — CID 118723076

IUPAC6-fluoro-2-(4-phenyl-2-pyridinyl)-1H-benzimidazole
SMILESFc1ccc2nc(-c3cc(-c4ccccc4)ccn3)[nH]c2c1
InChIInChI=1S/C18H12FN3/c19-14-6-7-15-16(11-14)22-18(21-15)17-10-13(8-9-20-17)12-4-2-1-3-5-12/h1-11H,(H,21,22)
InChIKeyMNNZVNPYGSLVIH-UHFFFAOYSA-N
MW289.31 g/mol
LogP4.43
Rot. Bonds2

About 6-fluoro-2-(4-phenyl-2-pyridinyl)-1H-benzimidazole

6-fluoro-2-(4-phenyl-2-pyridinyl)-1H-benzimidazole (PubChem CID 118723076) has the molecular formula C18H12FN3 and a molecular weight of 289.31 g/mol. Its IUPAC name is 6-fluoro-2-(4-phenyl-2-pyridinyl)-1H-benzimidazole.

Molecular Properties

Compound Name6-fluoro-2-(4-phenyl-2-pyridinyl)-1H-benzimidazole
PubChem CID118723076
Molecular FormulaC18H12FN3
Molecular Weight289.31 g/mol
Exact Mass289.10
IUPAC Name6-fluoro-2-(4-phenyl-2-pyridinyl)-1H-benzimidazole
SMILESFc1ccc2nc(-c3cc(-c4ccccc4)ccn3)[nH]c2c1
InChIInChI=1S/C18H12FN3/c19-14-6-7-15-16(11-14)22-18(21-15)17-10-13(8-9-20-17)12-4-2-1-3-5-12/h1-11H,(H,21,22)
InChIKeyMNNZVNPYGSLVIH-UHFFFAOYSA-N
XLogP4.43
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.31
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 6-fluoro-2-(4-phenyl-2-pyridinyl)-1H-benzimidazole 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 6-fluoro-2-(4-phenyl-2-pyridinyl)-1H-benzimidazole?
The IUPAC name of 6-fluoro-2-(4-phenyl-2-pyridinyl)-1H-benzimidazole (CID 118723076) is 6-fluoro-2-(4-phenyl-2-pyridinyl)-1H-benzimidazole.
What is the SMILES notation for 6-fluoro-2-(4-phenyl-2-pyridinyl)-1H-benzimidazole?
The canonical SMILES for 6-fluoro-2-(4-phenyl-2-pyridinyl)-1H-benzimidazole is Fc1ccc2nc(-c3cc(-c4ccccc4)ccn3)[nH]c2c1.
What is the InChIKey of 6-fluoro-2-(4-phenyl-2-pyridinyl)-1H-benzimidazole?
The InChIKey is MNNZVNPYGSLVIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12FN3/c19-14-6-7-15-16(11-14)22-18(21-15)17-10-13(8-9-20-17)12-4-2-1-3-5-12/h1-11H,(H,21,22).
What are the key properties of 6-fluoro-2-(4-phenyl-2-pyridinyl)-1H-benzimidazole?
6-fluoro-2-(4-phenyl-2-pyridinyl)-1H-benzimidazole has a molecular weight of 289.31 g/mol, XLogP of 4.43, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-2-(4-phenyl-2-pyridinyl)-1H-benzimidazole is sourced from PubChem (CID 118723076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).