(2S)-1-hydroxy-2-(4-methoxyphenyl)-5,5-dimethyl-4-phenyl-2H-imidazole

C18H20N2O2 — CID 781273

IUPAC(2S)-1-hydroxy-2-(4-methoxyphenyl)-5,5-dimethyl-4-phenyl-2H-imidazole
SMILESCOc1ccc([C@H]2N=C(c3ccccc3)C(C)(C)N2O)cc1
InChIInChI=1S/C18H20N2O2/c1-18(2)16(13-7-5-4-6-8-13)19-17(20(18)21)14-9-11-15(22-3)12-10-14/h4-12,17,21H,1-3H3/t17-/m0/s1
InChIKeyUKIBVZMINPNSNM-KRWDZBQOSA-N
MW296.37 g/mol
LogP3.67
Rot. Bonds3

About (2S)-1-hydroxy-2-(4-methoxyphenyl)-5,5-dimethyl-4-phenyl-2H-imidazole

(2S)-1-hydroxy-2-(4-methoxyphenyl)-5,5-dimethyl-4-phenyl-2H-imidazole (PubChem CID 781273) has the molecular formula C18H20N2O2 and a molecular weight of 296.37 g/mol. Its IUPAC name is (2S)-1-hydroxy-2-(4-methoxyphenyl)-5,5-dimethyl-4-phenyl-2H-imidazole.

Molecular Properties

Compound Name(2S)-1-hydroxy-2-(4-methoxyphenyl)-5,5-dimethyl-4-phenyl-2H-imidazole
PubChem CID781273
Molecular FormulaC18H20N2O2
Molecular Weight296.37 g/mol
Exact Mass296.15
IUPAC Name(2S)-1-hydroxy-2-(4-methoxyphenyl)-5,5-dimethyl-4-phenyl-2H-imidazole
SMILESCOc1ccc([C@H]2N=C(c3ccccc3)C(C)(C)N2O)cc1
InChIInChI=1S/C18H20N2O2/c1-18(2)16(13-7-5-4-6-8-13)19-17(20(18)21)14-9-11-15(22-3)12-10-14/h4-12,17,21H,1-3H3/t17-/m0/s1
InChIKeyUKIBVZMINPNSNM-KRWDZBQOSA-N
XLogP3.67
TPSA45.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[(2S)-2-(3,4-dimethoxyphenyl)-5,5-dimethyl-4-phenyl-2H-imidazol-1-yl] acetate
CID 1124736
3-(4-methoxyphenyl)-2-methyl-5-phenyl-3H-1,2,4-oxadiazole
CID 15528346
1-methoxy-4-(3-phenylcyclobutyl)benzene
CID 125465439
4,4-dibromo-2-(4-methoxyphenyl)-5-phenylpyrazol-3-one
CID 102048330
4-ethyl-1-hydroxy-2-(2-methoxyphenyl)-5,5-dimethyl-2H-imidazole
CID 2843908
(4R,5R)-5-(4-methoxyphenyl)-3-phenyl-4,5-dihydro-1,2-oxazole-4-carboxylic acid
CID 95988225
(4S,5S)-5-(4-methoxyphenyl)-3-phenyl-4,5-dihydro-1,2-oxazole-4-carboxylic acid
CID 95988226
(3S)-3-(4-methoxyphenyl)-5-phenyl-3,4-dihydropyrazole-2-carbothioamide
CID 7357012
2-(4-chlorophenyl)-4-(4-methoxyphenyl)-6-phenyl-1,3-diazabicyclo[3.1.0]hex-3-ene
CID 4169624
(2R,5S,6R)-4-(4-chlorophenyl)-2-(4-methoxyphenyl)-6-phenyl-1,3-diazabicyclo[3.1.0]hex-3-ene
CID 92838338
1-methoxy-4-phenylbenzene;methyloxidanium
CID 144616924
1-methoxy-4-phenylbenzene;4-(4-methoxyphenyl)phenol
CID 69347648

Frequently Asked Questions

What is the IUPAC name of (2S)-1-hydroxy-2-(4-methoxyphenyl)-5,5-dimethyl-4-phenyl-2H-imidazole?
The IUPAC name of (2S)-1-hydroxy-2-(4-methoxyphenyl)-5,5-dimethyl-4-phenyl-2H-imidazole (CID 781273) is (2S)-1-hydroxy-2-(4-methoxyphenyl)-5,5-dimethyl-4-phenyl-2H-imidazole.
What is the SMILES notation for (2S)-1-hydroxy-2-(4-methoxyphenyl)-5,5-dimethyl-4-phenyl-2H-imidazole?
The canonical SMILES for (2S)-1-hydroxy-2-(4-methoxyphenyl)-5,5-dimethyl-4-phenyl-2H-imidazole is COc1ccc([C@H]2N=C(c3ccccc3)C(C)(C)N2O)cc1.
What is the InChIKey of (2S)-1-hydroxy-2-(4-methoxyphenyl)-5,5-dimethyl-4-phenyl-2H-imidazole?
The InChIKey is UKIBVZMINPNSNM-KRWDZBQOSA-N. The full InChI is InChI=1S/C18H20N2O2/c1-18(2)16(13-7-5-4-6-8-13)19-17(20(18)21)14-9-11-15(22-3)12-10-14/h4-12,17,21H,1-3H3/t17-/m0/s1.
What are the key properties of (2S)-1-hydroxy-2-(4-methoxyphenyl)-5,5-dimethyl-4-phenyl-2H-imidazole?
(2S)-1-hydroxy-2-(4-methoxyphenyl)-5,5-dimethyl-4-phenyl-2H-imidazole has a molecular weight of 296.37 g/mol, XLogP of 3.67, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-hydroxy-2-(4-methoxyphenyl)-5,5-dimethyl-4-phenyl-2H-imidazole is sourced from PubChem (CID 781273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).