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

C14H18N2O — CID 66162644

IUPAC2-phenyl-1-(3-propan-2-ylimidazol-4-yl)ethanol
SMILESCC(C)n1cncc1C(O)Cc1ccccc1
InChIInChI=1S/C14H18N2O/c1-11(2)16-10-15-9-13(16)14(17)8-12-6-4-3-5-7-12/h3-7,9-11,14,17H,8H2,1-2H3
InChIKeyXZXAYMHBOLWUID-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.74
Rot. Bonds4

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

2-phenyl-1-(3-propan-2-ylimidazol-4-yl)ethanol (PubChem CID 66162644) has the molecular formula C14H18N2O and a molecular weight of 230.31 g/mol. Its IUPAC name is 2-phenyl-1-(3-propan-2-ylimidazol-4-yl)ethanol.

Molecular Properties

Compound Name2-phenyl-1-(3-propan-2-ylimidazol-4-yl)ethanol
PubChem CID66162644
Molecular FormulaC14H18N2O
Molecular Weight230.31 g/mol
Exact Mass230.14
IUPAC Name2-phenyl-1-(3-propan-2-ylimidazol-4-yl)ethanol
SMILESCC(C)n1cncc1C(O)Cc1ccccc1
InChIInChI=1S/C14H18N2O/c1-11(2)16-10-15-9-13(16)14(17)8-12-6-4-3-5-7-12/h3-7,9-11,14,17H,8H2,1-2H3
InChIKeyXZXAYMHBOLWUID-UHFFFAOYSA-N
XLogP2.74
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3,4-dimethylphenyl)-1-(3-propan-2-ylimidazol-4-yl)ethanol
CID 66164033
1-(3-propan-2-ylimidazol-4-yl)-2-thiophen-3-ylethanol
CID 66162635
2-(2-methoxyphenyl)-1-(3-propan-2-ylimidazol-4-yl)ethanol
CID 66162236
1-(3-methylimidazol-4-yl)-2-phenylethanol
CID 66118824
2-(3,4-difluorophenyl)-1-(3-propan-2-ylimidazol-4-yl)ethanol
CID 82920072
2-(1-pentan-3-ylpyrazol-3-yl)-1-(3-propan-2-ylimidazol-4-yl)ethanol
CID 66163237
2-(3-bromothiophen-2-yl)-1-(3-propan-2-ylimidazol-4-yl)ethanol
CID 66162836
4-hydroxy-2-methyl-4-(3-propan-2-ylimidazol-4-yl)butanoic acid
CID 66130717
2-(5-bromo-2-fluorophenyl)-1-(3-propan-2-ylimidazol-4-yl)ethanol
CID 66163449
3-phenyl-2-(5-propan-2-ylimidazol-1-yl)propanoic acid
CID 82514099
2-methyl-1-[3-(1-phenylpropan-2-yl)imidazol-4-yl]propan-1-amine
CID 102969714
1-(3-propan-2-ylimidazol-4-yl)-2-propoxyethanol
CID 79566864

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-1-(3-propan-2-ylimidazol-4-yl)ethanol?
The IUPAC name of 2-phenyl-1-(3-propan-2-ylimidazol-4-yl)ethanol (CID 66162644) is 2-phenyl-1-(3-propan-2-ylimidazol-4-yl)ethanol.
What is the SMILES notation for 2-phenyl-1-(3-propan-2-ylimidazol-4-yl)ethanol?
The canonical SMILES for 2-phenyl-1-(3-propan-2-ylimidazol-4-yl)ethanol is CC(C)n1cncc1C(O)Cc1ccccc1.
What is the InChIKey of 2-phenyl-1-(3-propan-2-ylimidazol-4-yl)ethanol?
The InChIKey is XZXAYMHBOLWUID-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O/c1-11(2)16-10-15-9-13(16)14(17)8-12-6-4-3-5-7-12/h3-7,9-11,14,17H,8H2,1-2H3.
What are the key properties of 2-phenyl-1-(3-propan-2-ylimidazol-4-yl)ethanol?
2-phenyl-1-(3-propan-2-ylimidazol-4-yl)ethanol has a molecular weight of 230.31 g/mol, XLogP of 2.74, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-1-(3-propan-2-ylimidazol-4-yl)ethanol is sourced from PubChem (CID 66162644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).