(1S)-2-imidazol-1-yl-1-[4-(2-phenylethyl)phenyl]ethanol

C19H20N2O — CID 76965185

IUPAC(1S)-2-imidazol-1-yl-1-[4-(2-phenylethyl)phenyl]ethanol
SMILESO[C@H](Cn1ccnc1)c1ccc(CCc2ccccc2)cc1
InChIInChI=1S/C19H20N2O/c22-19(14-21-13-12-20-15-21)18-10-8-17(9-11-18)7-6-16-4-2-1-3-5-16/h1-5,8-13,15,19,22H,6-7,14H2/t19-/m1/s1
InChIKeyIAWIJHCUEPVIOO-LJQANCHMSA-N
MW292.38 g/mol
LogP3.40
Rot. Bonds6

About (1S)-2-imidazol-1-yl-1-[4-(2-phenylethyl)phenyl]ethanol

(1S)-2-imidazol-1-yl-1-[4-(2-phenylethyl)phenyl]ethanol (PubChem CID 76965185) has the molecular formula C19H20N2O and a molecular weight of 292.38 g/mol. Its IUPAC name is (1S)-2-imidazol-1-yl-1-[4-(2-phenylethyl)phenyl]ethanol.

Molecular Properties

Compound Name(1S)-2-imidazol-1-yl-1-[4-(2-phenylethyl)phenyl]ethanol
PubChem CID76965185
Molecular FormulaC19H20N2O
Molecular Weight292.38 g/mol
Exact Mass292.16
IUPAC Name(1S)-2-imidazol-1-yl-1-[4-(2-phenylethyl)phenyl]ethanol
SMILESO[C@H](Cn1ccnc1)c1ccc(CCc2ccccc2)cc1
InChIInChI=1S/C19H20N2O/c22-19(14-21-13-12-20-15-21)18-10-8-17(9-11-18)7-6-16-4-2-1-3-5-16/h1-5,8-13,15,19,22H,6-7,14H2/t19-/m1/s1
InChIKeyIAWIJHCUEPVIOO-LJQANCHMSA-N
XLogP3.40
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

{3-[(1H-imidazol-1-yl)methyl]phenyl}methanol
CID 10397593
alpha-(4-(2-Phenylethyl)phenyl)-1H-imidazole-1-ethanol
CID 53626
{4-[(1H-Imidazol-1-yl)methyl]phenyl}methanol
CID 15594569
(1-Methylimidazol-2-yl)-diphenylmethanol
CID 3113722
Bis(1-methylimidazol-2-yl)-phenylmethanol
CID 2849523
2-(1H-imidazol-1-yl)-1-phenylethanol
CID 32239
Denzimol hydrochloride
CID 53625
(1-methyl-1H-imidazol-2-yl)(phenyl)methanol
CID 2859379
4''-(1H-Imidazol-1-yl-propyl)-biphenyl-4-ol
CID 42642716
rac-4''-(1-Imidazol-1-yl-propyl)-biphenyl-3-ol
CID 42642717
1-(2-Hydroxy-4-phenylbutyl)imidazole
CID 13457355
1-Imidazol-1-yl-4-phenylbutan-2-ol;hydrochloride
CID 25143490

Frequently Asked Questions

What is the IUPAC name of (1S)-2-imidazol-1-yl-1-[4-(2-phenylethyl)phenyl]ethanol?
The IUPAC name of (1S)-2-imidazol-1-yl-1-[4-(2-phenylethyl)phenyl]ethanol (CID 76965185) is (1S)-2-imidazol-1-yl-1-[4-(2-phenylethyl)phenyl]ethanol.
What is the SMILES notation for (1S)-2-imidazol-1-yl-1-[4-(2-phenylethyl)phenyl]ethanol?
The canonical SMILES for (1S)-2-imidazol-1-yl-1-[4-(2-phenylethyl)phenyl]ethanol is O[C@H](Cn1ccnc1)c1ccc(CCc2ccccc2)cc1.
What is the InChIKey of (1S)-2-imidazol-1-yl-1-[4-(2-phenylethyl)phenyl]ethanol?
The InChIKey is IAWIJHCUEPVIOO-LJQANCHMSA-N. The full InChI is InChI=1S/C19H20N2O/c22-19(14-21-13-12-20-15-21)18-10-8-17(9-11-18)7-6-16-4-2-1-3-5-16/h1-5,8-13,15,19,22H,6-7,14H2/t19-/m1/s1.
What are the key properties of (1S)-2-imidazol-1-yl-1-[4-(2-phenylethyl)phenyl]ethanol?
(1S)-2-imidazol-1-yl-1-[4-(2-phenylethyl)phenyl]ethanol has a molecular weight of 292.38 g/mol, XLogP of 3.40, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-2-imidazol-1-yl-1-[4-(2-phenylethyl)phenyl]ethanol is sourced from PubChem (CID 76965185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).