1-[(2-fluorophenyl)methyl]-2-(naphthalen-1-ylmethyl)benzimidazole

C25H19FN2 — CID 4631818

IUPAC1-[(2-fluorophenyl)methyl]-2-(naphthalen-1-ylmethyl)benzimidazole
SMILESFc1ccccc1Cn1c(Cc2cccc3ccccc23)nc2ccccc21
InChIInChI=1S/C25H19FN2/c26-22-13-4-2-9-20(22)17-28-24-15-6-5-14-23(24)27-25(28)16-19-11-7-10-18-8-1-3-12-21(18)19/h1-15H,16-17H2
InChIKeyWWUWXKUZDQVFHV-UHFFFAOYSA-N
MW366.44 g/mol
LogP5.97
Rot. Bonds4

About 1-[(2-fluorophenyl)methyl]-2-(naphthalen-1-ylmethyl)benzimidazole

1-[(2-fluorophenyl)methyl]-2-(naphthalen-1-ylmethyl)benzimidazole (PubChem CID 4631818) has the molecular formula C25H19FN2 and a molecular weight of 366.44 g/mol. Its IUPAC name is 1-[(2-fluorophenyl)methyl]-2-(naphthalen-1-ylmethyl)benzimidazole.

Molecular Properties

Compound Name1-[(2-fluorophenyl)methyl]-2-(naphthalen-1-ylmethyl)benzimidazole
PubChem CID4631818
Molecular FormulaC25H19FN2
Molecular Weight366.44 g/mol
Exact Mass366.15
IUPAC Name1-[(2-fluorophenyl)methyl]-2-(naphthalen-1-ylmethyl)benzimidazole
SMILESFc1ccccc1Cn1c(Cc2cccc3ccccc23)nc2ccccc21
InChIInChI=1S/C25H19FN2/c26-22-13-4-2-9-20(22)17-28-24-15-6-5-14-23(24)27-25(28)16-19-11-7-10-18-8-1-3-12-21(18)19/h1-15H,16-17H2
InChIKeyWWUWXKUZDQVFHV-UHFFFAOYSA-N
XLogP5.97
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.44
LogP ≤ 55.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-[[1-[(2-fluorophenyl)methyl]benzimidazol-2-yl]methyl]-5-methyl-1,2,4-oxadiazole
CID 16615330
1-[(2-fluorophenyl)methyl]benzimidazol-2-amine
CID 886688
3-[2-(naphthalen-1-ylmethyl)benzimidazol-1-yl]propane-1,2-diol
CID 45144760
2-[(4-chlorophenyl)sulfanylmethyl]-1-[(2-fluorophenyl)methyl]benzimidazole
CID 18878248
1-[(2-fluorophenyl)methyl]-2-methylsulfanylbenzimidazole
CID 690627
1-[(2-fluorophenyl)methyl]benzimidazole-2-carbaldehyde
CID 53262927
N-ethyl-2-[2-(naphthalen-1-ylmethyl)benzimidazol-1-yl]acetamide
CID 17033441
2-fluoro-N-[[1-[(2-fluorophenyl)methyl]benzimidazol-2-yl]methyl]benzamide
CID 17007755
2-[(4-tert-butylphenoxy)methyl]-1-[(2-fluorophenyl)methyl]benzimidazole
CID 16998729
2-tert-butyl-1-(naphthalen-1-ylmethyl)benzimidazole
CID 18811357
2-chloro-N-[2-[1-[(2-fluorophenyl)methyl]benzimidazol-2-yl]ethyl]benzamide
CID 16976056
1-[(2-fluorophenyl)methyl]-2-[(2-prop-2-enylphenoxy)methyl]benzimidazole
CID 18878085

Frequently Asked Questions

What is the IUPAC name of 1-[(2-fluorophenyl)methyl]-2-(naphthalen-1-ylmethyl)benzimidazole?
The IUPAC name of 1-[(2-fluorophenyl)methyl]-2-(naphthalen-1-ylmethyl)benzimidazole (CID 4631818) is 1-[(2-fluorophenyl)methyl]-2-(naphthalen-1-ylmethyl)benzimidazole.
What is the SMILES notation for 1-[(2-fluorophenyl)methyl]-2-(naphthalen-1-ylmethyl)benzimidazole?
The canonical SMILES for 1-[(2-fluorophenyl)methyl]-2-(naphthalen-1-ylmethyl)benzimidazole is Fc1ccccc1Cn1c(Cc2cccc3ccccc23)nc2ccccc21.
What is the InChIKey of 1-[(2-fluorophenyl)methyl]-2-(naphthalen-1-ylmethyl)benzimidazole?
The InChIKey is WWUWXKUZDQVFHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H19FN2/c26-22-13-4-2-9-20(22)17-28-24-15-6-5-14-23(24)27-25(28)16-19-11-7-10-18-8-1-3-12-21(18)19/h1-15H,16-17H2.
What are the key properties of 1-[(2-fluorophenyl)methyl]-2-(naphthalen-1-ylmethyl)benzimidazole?
1-[(2-fluorophenyl)methyl]-2-(naphthalen-1-ylmethyl)benzimidazole has a molecular weight of 366.44 g/mol, XLogP of 5.97, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-fluorophenyl)methyl]-2-(naphthalen-1-ylmethyl)benzimidazole is sourced from PubChem (CID 4631818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).