2-ethoxy-1-(1-ethylimidazol-2-yl)-2-phenylethanol

C15H20N2O2 — CID 116757187

IUPAC2-ethoxy-1-(1-ethylimidazol-2-yl)-2-phenylethanol
SMILESCCOC(c1ccccc1)C(O)c1nccn1CC
InChIInChI=1S/C15H20N2O2/c1-3-17-11-10-16-15(17)13(18)14(19-4-2)12-8-6-5-7-9-12/h5-11,13-14,18H,3-4H2,1-2H3
InChIKeyZHTPOFVXQIBSPO-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.71
Rot. Bonds6

About 2-ethoxy-1-(1-ethylimidazol-2-yl)-2-phenylethanol

2-ethoxy-1-(1-ethylimidazol-2-yl)-2-phenylethanol (PubChem CID 116757187) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 2-ethoxy-1-(1-ethylimidazol-2-yl)-2-phenylethanol.

Molecular Properties

Compound Name2-ethoxy-1-(1-ethylimidazol-2-yl)-2-phenylethanol
PubChem CID116757187
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name2-ethoxy-1-(1-ethylimidazol-2-yl)-2-phenylethanol
SMILESCCOC(c1ccccc1)C(O)c1nccn1CC
InChIInChI=1S/C15H20N2O2/c1-3-17-11-10-16-15(17)13(18)14(19-4-2)12-8-6-5-7-9-12/h5-11,13-14,18H,3-4H2,1-2H3
InChIKeyZHTPOFVXQIBSPO-UHFFFAOYSA-N
XLogP2.71
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-ethoxy-1,2-diphenylethanol
CID 3767197
2-ethoxy-1-(1-ethylimidazol-2-yl)-3-methylbutan-1-ol
CID 116712316
2-ethoxy-1-(1-methylimidazol-2-yl)-2-phenylethanamine
CID 116773334
1-(1-ethylimidazol-2-yl)-2-phenylethanol
CID 63976496
1-ethoxy-1-phenyl-3-pyridin-4-ylpropan-2-ol
CID 116757045
1-(1-ethylimidazol-2-yl)-2-methoxypropan-1-ol
CID 79616649
2-ethoxy-1-(2-ethoxyphenyl)-2-phenylethanol
CID 116757235
1-(1-ethylimidazol-2-yl)-3,3-dimethylbutane-1,2-diol
CID 103457324
2-ethoxy-1-(4-methoxyphenyl)-2-phenylethanol
CID 116757104
(3R,6S)-1,8-diethoxy-2,3,6,7-tetrahydroxy-1,8-diphenyloctane-4,5-dione
CID 54296354
1-cyclopropyl-2-(1-ethylimidazol-2-yl)ethane-1,2-diol
CID 103456993
3-(1-ethylimidazol-2-yl)-2,3-dihydroxypropanamide
CID 171869595

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-1-(1-ethylimidazol-2-yl)-2-phenylethanol?
The IUPAC name of 2-ethoxy-1-(1-ethylimidazol-2-yl)-2-phenylethanol (CID 116757187) is 2-ethoxy-1-(1-ethylimidazol-2-yl)-2-phenylethanol.
What is the SMILES notation for 2-ethoxy-1-(1-ethylimidazol-2-yl)-2-phenylethanol?
The canonical SMILES for 2-ethoxy-1-(1-ethylimidazol-2-yl)-2-phenylethanol is CCOC(c1ccccc1)C(O)c1nccn1CC.
What is the InChIKey of 2-ethoxy-1-(1-ethylimidazol-2-yl)-2-phenylethanol?
The InChIKey is ZHTPOFVXQIBSPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-3-17-11-10-16-15(17)13(18)14(19-4-2)12-8-6-5-7-9-12/h5-11,13-14,18H,3-4H2,1-2H3.
What are the key properties of 2-ethoxy-1-(1-ethylimidazol-2-yl)-2-phenylethanol?
2-ethoxy-1-(1-ethylimidazol-2-yl)-2-phenylethanol has a molecular weight of 260.34 g/mol, XLogP of 2.71, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-1-(1-ethylimidazol-2-yl)-2-phenylethanol is sourced from PubChem (CID 116757187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).