[1-[2-(2-ethoxyphenoxy)ethyl]benzimidazol-2-yl]methanol

C18H20N2O3 — CID 16995292

IUPAC[1-[2-(2-ethoxyphenoxy)ethyl]benzimidazol-2-yl]methanol
SMILESCCOc1ccccc1OCCn1c(CO)nc2ccccc21
InChIInChI=1S/C18H20N2O3/c1-2-22-16-9-5-6-10-17(16)23-12-11-20-15-8-4-3-7-14(15)19-18(20)13-21/h3-10,21H,2,11-13H2,1H3
InChIKeyKWFRURNVLTVHHC-UHFFFAOYSA-N
MW312.37 g/mol
LogP3.01
Rot. Bonds7

About [1-[2-(2-ethoxyphenoxy)ethyl]benzimidazol-2-yl]methanol

[1-[2-(2-ethoxyphenoxy)ethyl]benzimidazol-2-yl]methanol (PubChem CID 16995292) has the molecular formula C18H20N2O3 and a molecular weight of 312.37 g/mol. Its IUPAC name is [1-[2-(2-ethoxyphenoxy)ethyl]benzimidazol-2-yl]methanol.

Molecular Properties

Compound Name[1-[2-(2-ethoxyphenoxy)ethyl]benzimidazol-2-yl]methanol
PubChem CID16995292
Molecular FormulaC18H20N2O3
Molecular Weight312.37 g/mol
Exact Mass312.15
IUPAC Name[1-[2-(2-ethoxyphenoxy)ethyl]benzimidazol-2-yl]methanol
SMILESCCOc1ccccc1OCCn1c(CO)nc2ccccc21
InChIInChI=1S/C18H20N2O3/c1-2-22-16-9-5-6-10-17(16)23-12-11-20-15-8-4-3-7-14(15)19-18(20)13-21/h3-10,21H,2,11-13H2,1H3
InChIKeyKWFRURNVLTVHHC-UHFFFAOYSA-N
XLogP3.01
TPSA56.51 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[2-(2-ethoxyphenoxy)ethyl]-2-propan-2-ylbenzimidazole
CID 16996515
N-[2-[1-[2-(2-ethoxyphenoxy)ethyl]benzimidazol-2-yl]ethyl]-2-methoxyacetamide
CID 16974588
N-[[1-[2-(2-ethoxyphenoxy)ethyl]benzimidazol-2-yl]methyl]cyclopropanecarboxamide
CID 16969834
3-[1-[2-(2-methoxyphenoxy)ethyl]benzimidazol-2-yl]propan-1-ol
CID 16995480
4-bromo-N-[[1-[2-(2-ethoxyphenoxy)ethyl]benzimidazol-2-yl]methyl]benzamide
CID 17009197
N-[5-[1-[2-(2-ethoxyphenoxy)ethyl]benzimidazol-2-yl]pentyl]propanamide
CID 16988030
N-[[1-[2-(2-ethoxyphenoxy)ethyl]benzimidazol-2-yl]methyl]furan-2-carboxamide
CID 16973914
2-(4-bromophenyl)-1-[2-(2-ethoxyphenoxy)ethyl]benzimidazole
CID 17001175
N-[5-[1-[2-(2-ethoxyphenoxy)ethyl]benzimidazol-2-yl]pentyl]-2-methylprop-2-enamide
CID 16992404
2-[1-(2-naphthalen-1-yloxyethyl)benzimidazol-2-yl]ethanol
CID 19242359
N-[2-[1-[2-(2-ethoxyphenoxy)ethyl]benzimidazol-2-yl]ethyl]furan-2-carboxamide
CID 16975480
N-[2-[1-[2-(2-ethoxyphenoxy)ethyl]benzimidazol-2-yl]ethyl]cyclohexanecarboxamide
CID 16975077

Frequently Asked Questions

What is the IUPAC name of [1-[2-(2-ethoxyphenoxy)ethyl]benzimidazol-2-yl]methanol?
The IUPAC name of [1-[2-(2-ethoxyphenoxy)ethyl]benzimidazol-2-yl]methanol (CID 16995292) is [1-[2-(2-ethoxyphenoxy)ethyl]benzimidazol-2-yl]methanol.
What is the SMILES notation for [1-[2-(2-ethoxyphenoxy)ethyl]benzimidazol-2-yl]methanol?
The canonical SMILES for [1-[2-(2-ethoxyphenoxy)ethyl]benzimidazol-2-yl]methanol is CCOc1ccccc1OCCn1c(CO)nc2ccccc21.
What is the InChIKey of [1-[2-(2-ethoxyphenoxy)ethyl]benzimidazol-2-yl]methanol?
The InChIKey is KWFRURNVLTVHHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O3/c1-2-22-16-9-5-6-10-17(16)23-12-11-20-15-8-4-3-7-14(15)19-18(20)13-21/h3-10,21H,2,11-13H2,1H3.
What are the key properties of [1-[2-(2-ethoxyphenoxy)ethyl]benzimidazol-2-yl]methanol?
[1-[2-(2-ethoxyphenoxy)ethyl]benzimidazol-2-yl]methanol has a molecular weight of 312.37 g/mol, XLogP of 3.01, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[2-(2-ethoxyphenoxy)ethyl]benzimidazol-2-yl]methanol is sourced from PubChem (CID 16995292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).