1-(1H-imidazol-2-yl)-1-phenylethanol

C11H12N2O — CID 15123322

IUPAC1-(1H-imidazol-2-yl)-1-phenylethanol
SMILESCC(O)(c1ccccc1)c1ncc[nH]1
InChIInChI=1S/C11H12N2O/c1-11(14,10-12-7-8-13-10)9-5-3-2-4-6-9/h2-8,14H,1H3,(H,12,13)
InChIKeyCFWUNEPFIPLTSC-UHFFFAOYSA-N
MW188.23 g/mol
LogP1.67
Rot. Bonds2

About 1-(1H-imidazol-2-yl)-1-phenylethanol

1-(1H-imidazol-2-yl)-1-phenylethanol (PubChem CID 15123322) has the molecular formula C11H12N2O and a molecular weight of 188.23 g/mol. Its IUPAC name is 1-(1H-imidazol-2-yl)-1-phenylethanol.

Molecular Properties

Compound Name1-(1H-imidazol-2-yl)-1-phenylethanol
PubChem CID15123322
Molecular FormulaC11H12N2O
Molecular Weight188.23 g/mol
Exact Mass188.09
IUPAC Name1-(1H-imidazol-2-yl)-1-phenylethanol
SMILESCC(O)(c1ccccc1)c1ncc[nH]1
InChIInChI=1S/C11H12N2O/c1-11(14,10-12-7-8-13-10)9-5-3-2-4-6-9/h2-8,14H,1H3,(H,12,13)
InChIKeyCFWUNEPFIPLTSC-UHFFFAOYSA-N
XLogP1.67
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(1H-imidazol-2-yl)-1-phenylethanol?
The IUPAC name of 1-(1H-imidazol-2-yl)-1-phenylethanol (CID 15123322) is 1-(1H-imidazol-2-yl)-1-phenylethanol.
What is the SMILES notation for 1-(1H-imidazol-2-yl)-1-phenylethanol?
The canonical SMILES for 1-(1H-imidazol-2-yl)-1-phenylethanol is CC(O)(c1ccccc1)c1ncc[nH]1.
What is the InChIKey of 1-(1H-imidazol-2-yl)-1-phenylethanol?
The InChIKey is CFWUNEPFIPLTSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O/c1-11(14,10-12-7-8-13-10)9-5-3-2-4-6-9/h2-8,14H,1H3,(H,12,13).
What are the key properties of 1-(1H-imidazol-2-yl)-1-phenylethanol?
1-(1H-imidazol-2-yl)-1-phenylethanol has a molecular weight of 188.23 g/mol, XLogP of 1.67, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1H-imidazol-2-yl)-1-phenylethanol is sourced from PubChem (CID 15123322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).