[1-[(2-methoxyphenyl)methyl]benzimidazol-2-yl]methanol

C16H16N2O2 — CID 755585

IUPAC[1-[(2-methoxyphenyl)methyl]benzimidazol-2-yl]methanol
SMILESCOc1ccccc1Cn1c(CO)nc2ccccc21
InChIInChI=1S/C16H16N2O2/c1-20-15-9-5-2-6-12(15)10-18-14-8-4-3-7-13(14)17-16(18)11-19/h2-9,19H,10-11H2,1H3
InChIKeyVQAOBKHLDSXVAY-UHFFFAOYSA-N
MW268.32 g/mol
LogP2.59
Rot. Bonds4

About [1-[(2-methoxyphenyl)methyl]benzimidazol-2-yl]methanol

[1-[(2-methoxyphenyl)methyl]benzimidazol-2-yl]methanol (PubChem CID 755585) has the molecular formula C16H16N2O2 and a molecular weight of 268.32 g/mol. Its IUPAC name is [1-[(2-methoxyphenyl)methyl]benzimidazol-2-yl]methanol.

Molecular Properties

Compound Name[1-[(2-methoxyphenyl)methyl]benzimidazol-2-yl]methanol
PubChem CID755585
Molecular FormulaC16H16N2O2
Molecular Weight268.32 g/mol
Exact Mass268.12
IUPAC Name[1-[(2-methoxyphenyl)methyl]benzimidazol-2-yl]methanol
SMILESCOc1ccccc1Cn1c(CO)nc2ccccc21
InChIInChI=1S/C16H16N2O2/c1-20-15-9-5-2-6-12(15)10-18-14-8-4-3-7-13(14)17-16(18)11-19/h2-9,19H,10-11H2,1H3
InChIKeyVQAOBKHLDSXVAY-UHFFFAOYSA-N
XLogP2.59
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [1-[(2-methoxyphenyl)methyl]benzimidazol-2-yl]methanol?
The IUPAC name of [1-[(2-methoxyphenyl)methyl]benzimidazol-2-yl]methanol (CID 755585) is [1-[(2-methoxyphenyl)methyl]benzimidazol-2-yl]methanol.
What is the SMILES notation for [1-[(2-methoxyphenyl)methyl]benzimidazol-2-yl]methanol?
The canonical SMILES for [1-[(2-methoxyphenyl)methyl]benzimidazol-2-yl]methanol is COc1ccccc1Cn1c(CO)nc2ccccc21.
What is the InChIKey of [1-[(2-methoxyphenyl)methyl]benzimidazol-2-yl]methanol?
The InChIKey is VQAOBKHLDSXVAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O2/c1-20-15-9-5-2-6-12(15)10-18-14-8-4-3-7-13(14)17-16(18)11-19/h2-9,19H,10-11H2,1H3.
What are the key properties of [1-[(2-methoxyphenyl)methyl]benzimidazol-2-yl]methanol?
[1-[(2-methoxyphenyl)methyl]benzimidazol-2-yl]methanol has a molecular weight of 268.32 g/mol, XLogP of 2.59, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(2-methoxyphenyl)methyl]benzimidazol-2-yl]methanol is sourced from PubChem (CID 755585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).