2-[(2-phenyl-3H-benzimidazol-5-yl)oxy]ethanol

C15H14N2O2 — CID 84816371

IUPAC2-[(2-phenyl-3H-benzimidazol-5-yl)oxy]ethanol
SMILESOCCOc1ccc2nc(-c3ccccc3)[nH]c2c1
InChIInChI=1S/C15H14N2O2/c18-8-9-19-12-6-7-13-14(10-12)17-15(16-13)11-4-2-1-3-5-11/h1-7,10,18H,8-9H2,(H,16,17)
InChIKeyTWQMXZBCBWQBEB-UHFFFAOYSA-N
MW254.29 g/mol
LogP2.60
Rot. Bonds4

About 2-[(2-phenyl-3H-benzimidazol-5-yl)oxy]ethanol

2-[(2-phenyl-3H-benzimidazol-5-yl)oxy]ethanol (PubChem CID 84816371) has the molecular formula C15H14N2O2 and a molecular weight of 254.29 g/mol. Its IUPAC name is 2-[(2-phenyl-3H-benzimidazol-5-yl)oxy]ethanol.

Molecular Properties

Compound Name2-[(2-phenyl-3H-benzimidazol-5-yl)oxy]ethanol
PubChem CID84816371
Molecular FormulaC15H14N2O2
Molecular Weight254.29 g/mol
Exact Mass254.11
IUPAC Name2-[(2-phenyl-3H-benzimidazol-5-yl)oxy]ethanol
SMILESOCCOc1ccc2nc(-c3ccccc3)[nH]c2c1
InChIInChI=1S/C15H14N2O2/c18-8-9-19-12-6-7-13-14(10-12)17-15(16-13)11-4-2-1-3-5-11/h1-7,10,18H,8-9H2,(H,16,17)
InChIKeyTWQMXZBCBWQBEB-UHFFFAOYSA-N
XLogP2.60
TPSA58.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-[(2-phenyl-3H-benzimidazol-5-yl)oxy]ethoxy]ethanamine
CID 84816368
2-[4-(6-bromo-1H-benzimidazol-2-yl)phenoxy]ethanol
CID 103597094
(2-phenyl-3H-benzimidazol-5-yl) acetate
CID 57208111
3-[[2-[4-(1H-benzimidazol-2-yl)phenyl]-3H-benzimidazol-5-yl]oxy]-N,N-dimethylpropan-1-amine
CID 138650020
4-(6-propoxy-1H-benzimidazol-2-yl)aniline
CID 82331892
2-(3-butoxyphenyl)-6-methoxy-1H-benzimidazole
CID 110538781
4-[[2-[4-[6-(4-amino-4-iminobutoxy)-1H-benzimidazol-2-yl]phenyl]-3H-benzimidazol-5-yl]oxy]butanimidamide
CID 138648896
2-[4-[10-[4-(1H-benzimidazol-2-yl)phenoxy]decoxy]phenyl]-1H-benzimidazole
CID 56656183
2-[4-[6-[4-(1H-benzimidazol-2-yl)phenoxy]hexoxy]phenyl]-1H-benzimidazole
CID 25255576
N,N-dihydroxy-2-phenyl-3H-benzimidazol-5-amine
CID 123138623
2-[4-[3-[4-(1H-benzimidazol-2-yl)phenoxy]propoxy]phenyl]-1H-benzimidazole
CID 24900492
2-phenyl-1H-benzo[f]benzimidazole
CID 13074514

Frequently Asked Questions

What is the IUPAC name of 2-[(2-phenyl-3H-benzimidazol-5-yl)oxy]ethanol?
The IUPAC name of 2-[(2-phenyl-3H-benzimidazol-5-yl)oxy]ethanol (CID 84816371) is 2-[(2-phenyl-3H-benzimidazol-5-yl)oxy]ethanol.
What is the SMILES notation for 2-[(2-phenyl-3H-benzimidazol-5-yl)oxy]ethanol?
The canonical SMILES for 2-[(2-phenyl-3H-benzimidazol-5-yl)oxy]ethanol is OCCOc1ccc2nc(-c3ccccc3)[nH]c2c1.
What is the InChIKey of 2-[(2-phenyl-3H-benzimidazol-5-yl)oxy]ethanol?
The InChIKey is TWQMXZBCBWQBEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O2/c18-8-9-19-12-6-7-13-14(10-12)17-15(16-13)11-4-2-1-3-5-11/h1-7,10,18H,8-9H2,(H,16,17).
What are the key properties of 2-[(2-phenyl-3H-benzimidazol-5-yl)oxy]ethanol?
2-[(2-phenyl-3H-benzimidazol-5-yl)oxy]ethanol has a molecular weight of 254.29 g/mol, XLogP of 2.60, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-phenyl-3H-benzimidazol-5-yl)oxy]ethanol is sourced from PubChem (CID 84816371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).