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

C13H10FN3 — CID 106753306

IUPAC6-fluoro-2-(2-methyl-4-pyridinyl)-1H-benzimidazole
SMILESCc1cc(-c2nc3ccc(F)cc3[nH]2)ccn1
InChIInChI=1S/C13H10FN3/c1-8-6-9(4-5-15-8)13-16-11-3-2-10(14)7-12(11)17-13/h2-7H,1H3,(H,16,17)
InChIKeyOQJCJHXFGLVUEO-UHFFFAOYSA-N
MW227.24 g/mol
LogP3.07
Rot. Bonds1

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

6-fluoro-2-(2-methyl-4-pyridinyl)-1H-benzimidazole (PubChem CID 106753306) has the molecular formula C13H10FN3 and a molecular weight of 227.24 g/mol. Its IUPAC name is 6-fluoro-2-(2-methyl-4-pyridinyl)-1H-benzimidazole.

Molecular Properties

Compound Name6-fluoro-2-(2-methyl-4-pyridinyl)-1H-benzimidazole
PubChem CID106753306
Molecular FormulaC13H10FN3
Molecular Weight227.24 g/mol
Exact Mass227.09
IUPAC Name6-fluoro-2-(2-methyl-4-pyridinyl)-1H-benzimidazole
SMILESCc1cc(-c2nc3ccc(F)cc3[nH]2)ccn1
InChIInChI=1S/C13H10FN3/c1-8-6-9(4-5-15-8)13-16-11-3-2-10(14)7-12(11)17-13/h2-7H,1H3,(H,16,17)
InChIKeyOQJCJHXFGLVUEO-UHFFFAOYSA-N
XLogP3.07
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.24
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-(6-fluoro-1H-benzimidazol-2-yl)-2-methylaniline
CID 54919597
6-fluoro-2-(4-phenyl-2-pyridinyl)-1H-benzimidazole
CID 118723076
2-(2-methyl-4-pyridinyl)-6,7-dihydro-1H-[1,4]dioxino[2,3-f]benzimidazole
CID 106753298
6-fluoro-2-(4-methylsulfanylphenyl)-1H-benzimidazole
CID 112730258
2-(3,4-diethoxyphenyl)-6-fluoro-1H-benzimidazole
CID 103597133
4-(6-fluoro-1H-benzimidazol-2-yl)aniline
CID 22387237
6-fluoro-2-pyrimidin-5-yl-1H-benzimidazole
CID 102922110
2-(4-chloro-3-fluorophenyl)-6-fluoro-1H-benzimidazole
CID 113227780
6-fluoro-2-(2-phenylpyrimidin-5-yl)-1H-benzimidazole
CID 56796622
4-(6-fluoro-1H-benzimidazol-2-yl)-2-methyl-1,3-thiazole
CID 65198564
6-fluoro-3-(2-methyl-4-pyridinyl)-1H-indole
CID 160738701
2-(2,6-difluorophenyl)-6-fluoro-1H-benzimidazole
CID 60979328

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-2-(2-methyl-4-pyridinyl)-1H-benzimidazole?
The IUPAC name of 6-fluoro-2-(2-methyl-4-pyridinyl)-1H-benzimidazole (CID 106753306) is 6-fluoro-2-(2-methyl-4-pyridinyl)-1H-benzimidazole.
What is the SMILES notation for 6-fluoro-2-(2-methyl-4-pyridinyl)-1H-benzimidazole?
The canonical SMILES for 6-fluoro-2-(2-methyl-4-pyridinyl)-1H-benzimidazole is Cc1cc(-c2nc3ccc(F)cc3[nH]2)ccn1.
What is the InChIKey of 6-fluoro-2-(2-methyl-4-pyridinyl)-1H-benzimidazole?
The InChIKey is OQJCJHXFGLVUEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10FN3/c1-8-6-9(4-5-15-8)13-16-11-3-2-10(14)7-12(11)17-13/h2-7H,1H3,(H,16,17).
What are the key properties of 6-fluoro-2-(2-methyl-4-pyridinyl)-1H-benzimidazole?
6-fluoro-2-(2-methyl-4-pyridinyl)-1H-benzimidazole has a molecular weight of 227.24 g/mol, XLogP of 3.07, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-2-(2-methyl-4-pyridinyl)-1H-benzimidazole is sourced from PubChem (CID 106753306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).