[1-[(3-fluorophenyl)methyl]-5-methoxybenzimidazol-2-yl]methanol

C16H15FN2O2 — CID 82334557

IUPAC[1-[(3-fluorophenyl)methyl]-5-methoxybenzimidazol-2-yl]methanol
SMILESCOc1ccc2c(c1)nc(CO)n2Cc1cccc(F)c1
InChIInChI=1S/C16H15FN2O2/c1-21-13-5-6-15-14(8-13)18-16(10-20)19(15)9-11-3-2-4-12(17)7-11/h2-8,20H,9-10H2,1H3
InChIKeySXRXKLAPVZMQBN-UHFFFAOYSA-N
MW286.31 g/mol
LogP2.72
Rot. Bonds4

About [1-[(3-fluorophenyl)methyl]-5-methoxybenzimidazol-2-yl]methanol

[1-[(3-fluorophenyl)methyl]-5-methoxybenzimidazol-2-yl]methanol (PubChem CID 82334557) has the molecular formula C16H15FN2O2 and a molecular weight of 286.31 g/mol. Its IUPAC name is [1-[(3-fluorophenyl)methyl]-5-methoxybenzimidazol-2-yl]methanol.

Molecular Properties

Compound Name[1-[(3-fluorophenyl)methyl]-5-methoxybenzimidazol-2-yl]methanol
PubChem CID82334557
Molecular FormulaC16H15FN2O2
Molecular Weight286.31 g/mol
Exact Mass286.11
IUPAC Name[1-[(3-fluorophenyl)methyl]-5-methoxybenzimidazol-2-yl]methanol
SMILESCOc1ccc2c(c1)nc(CO)n2Cc1cccc(F)c1
InChIInChI=1S/C16H15FN2O2/c1-21-13-5-6-15-14(8-13)18-16(10-20)19(15)9-11-3-2-4-12(17)7-11/h2-8,20H,9-10H2,1H3
InChIKeySXRXKLAPVZMQBN-UHFFFAOYSA-N
XLogP2.72
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.31
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[5-amino-1-[(3-fluorophenyl)methyl]benzimidazol-2-yl]methanol
CID 62594326
2-(chloromethyl)-5-fluoro-1-[(3-methoxyphenyl)methyl]benzimidazole
CID 61029065
[1-[(3-fluorophenyl)methyl]-6-iodoimidazo[4,5-b]pyridin-2-yl]methanol
CID 138522215
3-[1-[(3-fluorophenyl)methyl]-5-methylbenzimidazol-2-yl]propan-1-ol
CID 82333195
[1-[(3-fluorophenyl)methyl]-5-methylbenzimidazol-2-yl]methanethiol
CID 82333392
5-methoxy-1-(naphthalen-2-ylmethyl)-2-(2-phenylethyl)benzimidazole
CID 134083914
[1-ethyl-5-(4-methoxyphenyl)benzimidazol-2-yl]methanol
CID 67250603
(1-ethyl-5-fluorobenzimidazol-2-yl)methanol
CID 63756217
1-[(3-methoxyphenyl)methyl]-2-(phenoxymethyl)benzimidazole
CID 71620987
N-[[1-[(3-chlorophenyl)methyl]-5-methoxybenzimidazol-2-yl]methyl]-1-(furan-2-yl)methanamine
CID 134084189
1-[(4-fluorophenyl)methyl]-2-[(3-methoxyphenoxy)methyl]benzimidazole
CID 16998087
[2-[(3-fluorophenyl)methylsulfanyl]-1-[(4-methoxyphenyl)methyl]imidazol-4-yl]methanol
CID 7622044

Frequently Asked Questions

What is the IUPAC name of [1-[(3-fluorophenyl)methyl]-5-methoxybenzimidazol-2-yl]methanol?
The IUPAC name of [1-[(3-fluorophenyl)methyl]-5-methoxybenzimidazol-2-yl]methanol (CID 82334557) is [1-[(3-fluorophenyl)methyl]-5-methoxybenzimidazol-2-yl]methanol.
What is the SMILES notation for [1-[(3-fluorophenyl)methyl]-5-methoxybenzimidazol-2-yl]methanol?
The canonical SMILES for [1-[(3-fluorophenyl)methyl]-5-methoxybenzimidazol-2-yl]methanol is COc1ccc2c(c1)nc(CO)n2Cc1cccc(F)c1.
What is the InChIKey of [1-[(3-fluorophenyl)methyl]-5-methoxybenzimidazol-2-yl]methanol?
The InChIKey is SXRXKLAPVZMQBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15FN2O2/c1-21-13-5-6-15-14(8-13)18-16(10-20)19(15)9-11-3-2-4-12(17)7-11/h2-8,20H,9-10H2,1H3.
What are the key properties of [1-[(3-fluorophenyl)methyl]-5-methoxybenzimidazol-2-yl]methanol?
[1-[(3-fluorophenyl)methyl]-5-methoxybenzimidazol-2-yl]methanol has a molecular weight of 286.31 g/mol, XLogP of 2.72, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(3-fluorophenyl)methyl]-5-methoxybenzimidazol-2-yl]methanol is sourced from PubChem (CID 82334557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).