2-(benzimidazol-1-yl)-1-(3-ethylphenyl)ethanol

C17H18N2O — CID 105117176

IUPAC2-(benzimidazol-1-yl)-1-(3-ethylphenyl)ethanol
SMILESCCc1cccc(C(O)Cn2cnc3ccccc32)c1
InChIInChI=1S/C17H18N2O/c1-2-13-6-5-7-14(10-13)17(20)11-19-12-18-15-8-3-4-9-16(15)19/h3-10,12,17,20H,2,11H2,1H3
InChIKeyUFIBMRRFJAYBSY-UHFFFAOYSA-N
MW266.34 g/mol
LogP3.33
Rot. Bonds4

About 2-(benzimidazol-1-yl)-1-(3-ethylphenyl)ethanol

2-(benzimidazol-1-yl)-1-(3-ethylphenyl)ethanol (PubChem CID 105117176) has the molecular formula C17H18N2O and a molecular weight of 266.34 g/mol. Its IUPAC name is 2-(benzimidazol-1-yl)-1-(3-ethylphenyl)ethanol.

Molecular Properties

Compound Name2-(benzimidazol-1-yl)-1-(3-ethylphenyl)ethanol
PubChem CID105117176
Molecular FormulaC17H18N2O
Molecular Weight266.34 g/mol
Exact Mass266.14
IUPAC Name2-(benzimidazol-1-yl)-1-(3-ethylphenyl)ethanol
SMILESCCc1cccc(C(O)Cn2cnc3ccccc32)c1
InChIInChI=1S/C17H18N2O/c1-2-13-6-5-7-14(10-13)17(20)11-19-12-18-15-8-3-4-9-16(15)19/h3-10,12,17,20H,2,11H2,1H3
InChIKeyUFIBMRRFJAYBSY-UHFFFAOYSA-N
XLogP3.33
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(benzimidazol-1-yl)butan-2-ol
CID 53276318
1-(benzimidazol-1-yl)propan-2-ol
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1-(benzimidazol-1-yl)-3-methylbut-3-en-2-ol
CID 105110467
(2R)-3-(benzimidazol-1-yl)-2-methylpropanoic acid
CID 806595
1-(benzimidazol-1-yl)-3-(5-ethyl-2-pyridinyl)propan-2-amine
CID 105168831
1-(benzimidazol-1-yl)decan-2-ol
CID 105085738
3-[2-hydroxy-2-(3-methoxyphenyl)ethyl]quinazolin-4-one
CID 110885190
methyl 3-(benzimidazol-1-yl)-2-phenylpropanoate
CID 64567462
3-(benzimidazol-1-yl)-2-methylpropanamide
CID 112688309
[1-(benzimidazol-1-yl)-3-ethylpentan-2-yl]hydrazine
CID 105323983
(3S,4R)-5-(benzimidazol-1-yl)-4-hydroxy-3-methylpentan-2-one
CID 166448813

Frequently Asked Questions

What is the IUPAC name of 2-(benzimidazol-1-yl)-1-(3-ethylphenyl)ethanol?
The IUPAC name of 2-(benzimidazol-1-yl)-1-(3-ethylphenyl)ethanol (CID 105117176) is 2-(benzimidazol-1-yl)-1-(3-ethylphenyl)ethanol.
What is the SMILES notation for 2-(benzimidazol-1-yl)-1-(3-ethylphenyl)ethanol?
The canonical SMILES for 2-(benzimidazol-1-yl)-1-(3-ethylphenyl)ethanol is CCc1cccc(C(O)Cn2cnc3ccccc32)c1.
What is the InChIKey of 2-(benzimidazol-1-yl)-1-(3-ethylphenyl)ethanol?
The InChIKey is UFIBMRRFJAYBSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O/c1-2-13-6-5-7-14(10-13)17(20)11-19-12-18-15-8-3-4-9-16(15)19/h3-10,12,17,20H,2,11H2,1H3.
What are the key properties of 2-(benzimidazol-1-yl)-1-(3-ethylphenyl)ethanol?
2-(benzimidazol-1-yl)-1-(3-ethylphenyl)ethanol has a molecular weight of 266.34 g/mol, XLogP of 3.33, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzimidazol-1-yl)-1-(3-ethylphenyl)ethanol is sourced from PubChem (CID 105117176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).