4-fluoro-2-(2-fluoro-6-methoxyphenyl)-1H-benzimidazole

C14H10F2N2O — CID 65434615

IUPAC4-fluoro-2-(2-fluoro-6-methoxyphenyl)-1H-benzimidazole
SMILESCOc1cccc(F)c1-c1nc2c(F)cccc2[nH]1
InChIInChI=1S/C14H10F2N2O/c1-19-11-7-3-4-8(15)12(11)14-17-10-6-2-5-9(16)13(10)18-14/h2-7H,1H3,(H,17,18)
InChIKeyLCPSKBSBFOOLLX-UHFFFAOYSA-N
MW260.24 g/mol
LogP3.52
Rot. Bonds2

About 4-fluoro-2-(2-fluoro-6-methoxyphenyl)-1H-benzimidazole

4-fluoro-2-(2-fluoro-6-methoxyphenyl)-1H-benzimidazole (PubChem CID 65434615) has the molecular formula C14H10F2N2O and a molecular weight of 260.24 g/mol. Its IUPAC name is 4-fluoro-2-(2-fluoro-6-methoxyphenyl)-1H-benzimidazole.

Molecular Properties

Compound Name4-fluoro-2-(2-fluoro-6-methoxyphenyl)-1H-benzimidazole
PubChem CID65434615
Molecular FormulaC14H10F2N2O
Molecular Weight260.24 g/mol
Exact Mass260.08
IUPAC Name4-fluoro-2-(2-fluoro-6-methoxyphenyl)-1H-benzimidazole
SMILESCOc1cccc(F)c1-c1nc2c(F)cccc2[nH]1
InChIInChI=1S/C14H10F2N2O/c1-19-11-7-3-4-8(15)12(11)14-17-10-6-2-5-9(16)13(10)18-14/h2-7H,1H3,(H,17,18)
InChIKeyLCPSKBSBFOOLLX-UHFFFAOYSA-N
XLogP3.52
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.24
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2-(2-fluoro-6-methoxyphenyl)-1H-benzimidazole?
The IUPAC name of 4-fluoro-2-(2-fluoro-6-methoxyphenyl)-1H-benzimidazole (CID 65434615) is 4-fluoro-2-(2-fluoro-6-methoxyphenyl)-1H-benzimidazole.
What is the SMILES notation for 4-fluoro-2-(2-fluoro-6-methoxyphenyl)-1H-benzimidazole?
The canonical SMILES for 4-fluoro-2-(2-fluoro-6-methoxyphenyl)-1H-benzimidazole is COc1cccc(F)c1-c1nc2c(F)cccc2[nH]1.
What is the InChIKey of 4-fluoro-2-(2-fluoro-6-methoxyphenyl)-1H-benzimidazole?
The InChIKey is LCPSKBSBFOOLLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10F2N2O/c1-19-11-7-3-4-8(15)12(11)14-17-10-6-2-5-9(16)13(10)18-14/h2-7H,1H3,(H,17,18).
What are the key properties of 4-fluoro-2-(2-fluoro-6-methoxyphenyl)-1H-benzimidazole?
4-fluoro-2-(2-fluoro-6-methoxyphenyl)-1H-benzimidazole has a molecular weight of 260.24 g/mol, XLogP of 3.52, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2-(2-fluoro-6-methoxyphenyl)-1H-benzimidazole is sourced from PubChem (CID 65434615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).