2-(2-methoxyphenyl)-1-(3-propan-2-ylimidazol-4-yl)ethanol

C15H20N2O2 — CID 66162236

IUPAC2-(2-methoxyphenyl)-1-(3-propan-2-ylimidazol-4-yl)ethanol
SMILESCOc1ccccc1CC(O)c1cncn1C(C)C
InChIInChI=1S/C15H20N2O2/c1-11(2)17-10-16-9-13(17)14(18)8-12-6-4-5-7-15(12)19-3/h4-7,9-11,14,18H,8H2,1-3H3
InChIKeySGIWJSKLIKSEPD-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.75
Rot. Bonds5

About 2-(2-methoxyphenyl)-1-(3-propan-2-ylimidazol-4-yl)ethanol

2-(2-methoxyphenyl)-1-(3-propan-2-ylimidazol-4-yl)ethanol (PubChem CID 66162236) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 2-(2-methoxyphenyl)-1-(3-propan-2-ylimidazol-4-yl)ethanol.

Molecular Properties

Compound Name2-(2-methoxyphenyl)-1-(3-propan-2-ylimidazol-4-yl)ethanol
PubChem CID66162236
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name2-(2-methoxyphenyl)-1-(3-propan-2-ylimidazol-4-yl)ethanol
SMILESCOc1ccccc1CC(O)c1cncn1C(C)C
InChIInChI=1S/C15H20N2O2/c1-11(2)17-10-16-9-13(17)14(18)8-12-6-4-5-7-15(12)19-3/h4-7,9-11,14,18H,8H2,1-3H3
InChIKeySGIWJSKLIKSEPD-UHFFFAOYSA-N
XLogP2.75
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenyl)-1-(3-propan-2-ylimidazol-4-yl)ethanol?
The IUPAC name of 2-(2-methoxyphenyl)-1-(3-propan-2-ylimidazol-4-yl)ethanol (CID 66162236) is 2-(2-methoxyphenyl)-1-(3-propan-2-ylimidazol-4-yl)ethanol.
What is the SMILES notation for 2-(2-methoxyphenyl)-1-(3-propan-2-ylimidazol-4-yl)ethanol?
The canonical SMILES for 2-(2-methoxyphenyl)-1-(3-propan-2-ylimidazol-4-yl)ethanol is COc1ccccc1CC(O)c1cncn1C(C)C.
What is the InChIKey of 2-(2-methoxyphenyl)-1-(3-propan-2-ylimidazol-4-yl)ethanol?
The InChIKey is SGIWJSKLIKSEPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-11(2)17-10-16-9-13(17)14(18)8-12-6-4-5-7-15(12)19-3/h4-7,9-11,14,18H,8H2,1-3H3.
What are the key properties of 2-(2-methoxyphenyl)-1-(3-propan-2-ylimidazol-4-yl)ethanol?
2-(2-methoxyphenyl)-1-(3-propan-2-ylimidazol-4-yl)ethanol has a molecular weight of 260.34 g/mol, XLogP of 2.75, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenyl)-1-(3-propan-2-ylimidazol-4-yl)ethanol is sourced from PubChem (CID 66162236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).