[1-[(2-fluorophenyl)methyl]-5-methylbenzimidazol-2-yl]methanol

C16H15FN2O — CID 82333263

IUPAC[1-[(2-fluorophenyl)methyl]-5-methylbenzimidazol-2-yl]methanol
SMILESCc1ccc2c(c1)nc(CO)n2Cc1ccccc1F
InChIInChI=1S/C16H15FN2O/c1-11-6-7-15-14(8-11)18-16(10-20)19(15)9-12-4-2-3-5-13(12)17/h2-8,20H,9-10H2,1H3
InChIKeyLLCUCVKYMXKWFC-UHFFFAOYSA-N
MW270.31 g/mol
LogP3.02
Rot. Bonds3

About [1-[(2-fluorophenyl)methyl]-5-methylbenzimidazol-2-yl]methanol

[1-[(2-fluorophenyl)methyl]-5-methylbenzimidazol-2-yl]methanol (PubChem CID 82333263) has the molecular formula C16H15FN2O and a molecular weight of 270.31 g/mol. Its IUPAC name is [1-[(2-fluorophenyl)methyl]-5-methylbenzimidazol-2-yl]methanol.

Molecular Properties

Compound Name[1-[(2-fluorophenyl)methyl]-5-methylbenzimidazol-2-yl]methanol
PubChem CID82333263
Molecular FormulaC16H15FN2O
Molecular Weight270.31 g/mol
Exact Mass270.12
IUPAC Name[1-[(2-fluorophenyl)methyl]-5-methylbenzimidazol-2-yl]methanol
SMILESCc1ccc2c(c1)nc(CO)n2Cc1ccccc1F
InChIInChI=1S/C16H15FN2O/c1-11-6-7-15-14(8-11)18-16(10-20)19(15)9-12-4-2-3-5-13(12)17/h2-8,20H,9-10H2,1H3
InChIKeyLLCUCVKYMXKWFC-UHFFFAOYSA-N
XLogP3.02
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.31
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[5-methyl-1-[(2-methylphenyl)methyl]benzimidazol-2-yl]methanol
CID 82333264
2-(chloromethyl)-5-methyl-1-[(2-methylphenyl)methyl]benzimidazole
CID 60902601
2-[5-ethyl-1-[(2-fluorophenyl)methyl]benzimidazol-2-yl]ethanamine
CID 82333467
[5-ethyl-1-[(2-fluorophenyl)methyl]benzimidazol-2-yl]methanamine
CID 82333492
[1-[2-(dimethylamino)ethyl]-5-methylbenzimidazol-2-yl]methanol
CID 82333285
[5-ethoxy-1-[(2-fluorophenyl)methyl]benzimidazol-2-yl]methanamine
CID 82334694
3-[1-[(3-fluorophenyl)methyl]-5-methylbenzimidazol-2-yl]propan-1-ol
CID 82333195
(1-hexyl-5-methylbenzimidazol-2-yl)methanol
CID 82333270
[1-[3-(dimethylamino)propyl]-5-methylbenzimidazol-2-yl]methanol
CID 82333288
5-methyl-1-[(2-methylphenyl)methyl]benzimidazol-2-amine
CID 54944327
6-chloro-2-(2-chloroethyl)-1-[(2-fluorophenyl)methyl]benzimidazole
CID 115470803
1-[5-amino-1-[(2-fluorophenyl)methyl]benzimidazol-2-yl]ethanol
CID 62591100

Frequently Asked Questions

What is the IUPAC name of [1-[(2-fluorophenyl)methyl]-5-methylbenzimidazol-2-yl]methanol?
The IUPAC name of [1-[(2-fluorophenyl)methyl]-5-methylbenzimidazol-2-yl]methanol (CID 82333263) is [1-[(2-fluorophenyl)methyl]-5-methylbenzimidazol-2-yl]methanol.
What is the SMILES notation for [1-[(2-fluorophenyl)methyl]-5-methylbenzimidazol-2-yl]methanol?
The canonical SMILES for [1-[(2-fluorophenyl)methyl]-5-methylbenzimidazol-2-yl]methanol is Cc1ccc2c(c1)nc(CO)n2Cc1ccccc1F.
What is the InChIKey of [1-[(2-fluorophenyl)methyl]-5-methylbenzimidazol-2-yl]methanol?
The InChIKey is LLCUCVKYMXKWFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15FN2O/c1-11-6-7-15-14(8-11)18-16(10-20)19(15)9-12-4-2-3-5-13(12)17/h2-8,20H,9-10H2,1H3.
What are the key properties of [1-[(2-fluorophenyl)methyl]-5-methylbenzimidazol-2-yl]methanol?
[1-[(2-fluorophenyl)methyl]-5-methylbenzimidazol-2-yl]methanol has a molecular weight of 270.31 g/mol, XLogP of 3.02, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(2-fluorophenyl)methyl]-5-methylbenzimidazol-2-yl]methanol is sourced from PubChem (CID 82333263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).