2-(2,6-difluorophenyl)-6-fluoro-1H-benzimidazole

C13H7F3N2 — CID 60979328

IUPAC2-(2,6-difluorophenyl)-6-fluoro-1H-benzimidazole
SMILESFc1ccc2nc(-c3c(F)cccc3F)[nH]c2c1
InChIInChI=1S/C13H7F3N2/c14-7-4-5-10-11(6-7)18-13(17-10)12-8(15)2-1-3-9(12)16/h1-6H,(H,17,18)
InChIKeyUULYUSPLDWEVNE-UHFFFAOYSA-N
MW248.21 g/mol
LogP3.65
Rot. Bonds1

About 2-(2,6-difluorophenyl)-6-fluoro-1H-benzimidazole

2-(2,6-difluorophenyl)-6-fluoro-1H-benzimidazole (PubChem CID 60979328) has the molecular formula C13H7F3N2 and a molecular weight of 248.21 g/mol. Its IUPAC name is 2-(2,6-difluorophenyl)-6-fluoro-1H-benzimidazole.

Molecular Properties

Compound Name2-(2,6-difluorophenyl)-6-fluoro-1H-benzimidazole
PubChem CID60979328
Molecular FormulaC13H7F3N2
Molecular Weight248.21 g/mol
Exact Mass248.06
IUPAC Name2-(2,6-difluorophenyl)-6-fluoro-1H-benzimidazole
SMILESFc1ccc2nc(-c3c(F)cccc3F)[nH]c2c1
InChIInChI=1S/C13H7F3N2/c14-7-4-5-10-11(6-7)18-13(17-10)12-8(15)2-1-3-9(12)16/h1-6H,(H,17,18)
InChIKeyUULYUSPLDWEVNE-UHFFFAOYSA-N
XLogP3.65
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.21
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2,6-dichlorophenyl)-6-fluoro-1H-benzimidazole
CID 60979200
2-(2,6-dimethoxyphenyl)-6-fluoro-1H-benzimidazole
CID 60979329
2-(2-fluoro-6-hydroxyphenyl)-3H-benzimidazol-5-ol
CID 136959757
6-bromo-2-(2-bromo-6-fluorophenyl)-1H-benzimidazole
CID 114560115
2-(3-bromo-2-fluorophenyl)-6-fluoro-1H-benzimidazole
CID 114020270
4-(6-fluoro-1H-benzimidazol-2-yl)fluoren-9-one
CID 59208169
2-[3-(6-fluoro-1H-benzimidazol-2-yl)phenyl]ethanamine
CID 63793363
4-(6-fluoro-1H-benzimidazol-2-yl)aniline
CID 22387237
6-fluoro-2-pyrimidin-5-yl-1H-benzimidazole
CID 102922110
2-amino-6-(6-fluoro-1H-benzimidazol-2-yl)phenol
CID 136980082
2-[2-(difluoromethoxy)phenyl]-6-fluoro-1H-benzimidazole
CID 60981364
2-(4-chloro-3-fluorophenyl)-6-fluoro-1H-benzimidazole
CID 113227780

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-difluorophenyl)-6-fluoro-1H-benzimidazole?
The IUPAC name of 2-(2,6-difluorophenyl)-6-fluoro-1H-benzimidazole (CID 60979328) is 2-(2,6-difluorophenyl)-6-fluoro-1H-benzimidazole.
What is the SMILES notation for 2-(2,6-difluorophenyl)-6-fluoro-1H-benzimidazole?
The canonical SMILES for 2-(2,6-difluorophenyl)-6-fluoro-1H-benzimidazole is Fc1ccc2nc(-c3c(F)cccc3F)[nH]c2c1.
What is the InChIKey of 2-(2,6-difluorophenyl)-6-fluoro-1H-benzimidazole?
The InChIKey is UULYUSPLDWEVNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H7F3N2/c14-7-4-5-10-11(6-7)18-13(17-10)12-8(15)2-1-3-9(12)16/h1-6H,(H,17,18).
What are the key properties of 2-(2,6-difluorophenyl)-6-fluoro-1H-benzimidazole?
2-(2,6-difluorophenyl)-6-fluoro-1H-benzimidazole has a molecular weight of 248.21 g/mol, XLogP of 3.65, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-difluorophenyl)-6-fluoro-1H-benzimidazole is sourced from PubChem (CID 60979328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).