6-fluoro-2-[(4-fluorophenoxy)methyl]-1H-benzimidazole

C14H10F2N2O — CID 23613775

IUPAC6-fluoro-2-[(4-fluorophenoxy)methyl]-1H-benzimidazole
SMILESFc1ccc(OCc2nc3ccc(F)cc3[nH]2)cc1
InChIInChI=1S/C14H10F2N2O/c15-9-1-4-11(5-2-9)19-8-14-17-12-6-3-10(16)7-13(12)18-14/h1-7H,8H2,(H,17,18)
InChIKeyOMLUWTULKDEXNK-UHFFFAOYSA-N
MW260.24 g/mol
LogP3.42
Rot. Bonds3

About 6-fluoro-2-[(4-fluorophenoxy)methyl]-1H-benzimidazole

6-fluoro-2-[(4-fluorophenoxy)methyl]-1H-benzimidazole (PubChem CID 23613775) has the molecular formula C14H10F2N2O and a molecular weight of 260.24 g/mol. Its IUPAC name is 6-fluoro-2-[(4-fluorophenoxy)methyl]-1H-benzimidazole.

Molecular Properties

Compound Name6-fluoro-2-[(4-fluorophenoxy)methyl]-1H-benzimidazole
PubChem CID23613775
Molecular FormulaC14H10F2N2O
Molecular Weight260.24 g/mol
Exact Mass260.08
IUPAC Name6-fluoro-2-[(4-fluorophenoxy)methyl]-1H-benzimidazole
SMILESFc1ccc(OCc2nc3ccc(F)cc3[nH]2)cc1
InChIInChI=1S/C14H10F2N2O/c15-9-1-4-11(5-2-9)19-8-14-17-12-6-3-10(16)7-13(12)18-14/h1-7H,8H2,(H,17,18)
InChIKeyOMLUWTULKDEXNK-UHFFFAOYSA-N
XLogP3.42
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.24
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 6-fluoro-2-[(4-fluorophenoxy)methyl]-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

Related Compounds

6-fluoro-2-[(2-methoxyphenoxy)methyl]-1H-benzimidazole
CID 71296316
6-fluoro-2-[(6-fluoro-1H-benzimidazol-2-yl)methyl]-1H-benzimidazole
CID 71367754
2-[1-[4-[(2,5-difluorophenyl)methoxy]phenyl]ethoxymethyl]-6-fluoro-1H-benzimidazole
CID 71294532
2-[(4-chlorophenoxy)methyl]-5,6-difluoro-1H-benzimidazole
CID 60979188
2-[(4-ethylphenoxy)methyl]-5,6-difluoro-1H-benzimidazole
CID 82144371
5,6-difluoro-2-(phenoxymethyl)-1H-benzimidazole
CID 55025178
4-[(6-methoxy-1H-benzimidazol-2-yl)methoxy]aniline
CID 65017728
2-(6-fluoro-1H-benzimidazol-2-yl)ethanamine
CID 16767401
2-[(4-ethoxyphenoxy)methyl]-3H-benzimidazole-5-carbaldehyde
CID 84756475
6-fluoro-2-[[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]methyl]-1H-benzimidazole
CID 46264639
2-[6-[(4-fluorophenyl)methoxy]-1H-benzimidazol-2-yl]acetamide
CID 172638511
2-[(4-methylphenoxy)methyl]-3H-benzimidazole-5-carboxylic acid
CID 84756425

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-2-[(4-fluorophenoxy)methyl]-1H-benzimidazole?
The IUPAC name of 6-fluoro-2-[(4-fluorophenoxy)methyl]-1H-benzimidazole (CID 23613775) is 6-fluoro-2-[(4-fluorophenoxy)methyl]-1H-benzimidazole.
What is the SMILES notation for 6-fluoro-2-[(4-fluorophenoxy)methyl]-1H-benzimidazole?
The canonical SMILES for 6-fluoro-2-[(4-fluorophenoxy)methyl]-1H-benzimidazole is Fc1ccc(OCc2nc3ccc(F)cc3[nH]2)cc1.
What is the InChIKey of 6-fluoro-2-[(4-fluorophenoxy)methyl]-1H-benzimidazole?
The InChIKey is OMLUWTULKDEXNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10F2N2O/c15-9-1-4-11(5-2-9)19-8-14-17-12-6-3-10(16)7-13(12)18-14/h1-7H,8H2,(H,17,18).
What are the key properties of 6-fluoro-2-[(4-fluorophenoxy)methyl]-1H-benzimidazole?
6-fluoro-2-[(4-fluorophenoxy)methyl]-1H-benzimidazole has a molecular weight of 260.24 g/mol, XLogP of 3.42, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-2-[(4-fluorophenoxy)methyl]-1H-benzimidazole is sourced from PubChem (CID 23613775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).