2-(4-hydroxy-3,5-dimethylphenyl)-1-methylimidazol-4-ol

C12H14N2O2 — CID 136827210

IUPAC2-(4-hydroxy-3,5-dimethylphenyl)-1-methylimidazol-4-ol
SMILESCc1cc(-c2nc(O)cn2C)cc(C)c1O
InChIInChI=1S/C12H14N2O2/c1-7-4-9(5-8(2)11(7)16)12-13-10(15)6-14(12)3/h4-6,15-16H,1-3H3
InChIKeyVORBRNXGYZMRJG-UHFFFAOYSA-N
MW218.26 g/mol
LogP2.12
Rot. Bonds1

About 2-(4-hydroxy-3,5-dimethylphenyl)-1-methylimidazol-4-ol

2-(4-hydroxy-3,5-dimethylphenyl)-1-methylimidazol-4-ol (PubChem CID 136827210) has the molecular formula C12H14N2O2 and a molecular weight of 218.26 g/mol. Its IUPAC name is 2-(4-hydroxy-3,5-dimethylphenyl)-1-methylimidazol-4-ol.

Molecular Properties

Compound Name2-(4-hydroxy-3,5-dimethylphenyl)-1-methylimidazol-4-ol
PubChem CID136827210
Molecular FormulaC12H14N2O2
Molecular Weight218.26 g/mol
Exact Mass218.11
IUPAC Name2-(4-hydroxy-3,5-dimethylphenyl)-1-methylimidazol-4-ol
SMILESCc1cc(-c2nc(O)cn2C)cc(C)c1O
InChIInChI=1S/C12H14N2O2/c1-7-4-9(5-8(2)11(7)16)12-13-10(15)6-14(12)3/h4-6,15-16H,1-3H3
InChIKeyVORBRNXGYZMRJG-UHFFFAOYSA-N
XLogP2.12
TPSA58.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-fluorophenyl)-1-methylimidazol-4-ol
CID 106952412
1-methyl-2-quinolin-6-ylimidazol-4-ol
CID 106952318
1-methyl-2-(3-nitrophenyl)imidazol-4-ol
CID 106952341
1-methyl-2-(4-methyl-3-pyridinyl)imidazol-4-ol
CID 106952509
5-(4-hydroxy-3,5-dimethylphenyl)-3-methylbenzene-1,2-diol
CID 130228173
[2-methyl-4-[1-methyl-4-(trifluoromethyl)imidazol-2-yl]phenyl]methanol
CID 164881354
2,6-dimethyl-4-(5-methyl-1,2,4-oxadiazol-3-yl)phenol
CID 135449004
5-(3,4-dihydroxy-5-methylphenyl)-3-methylbenzene-1,2-diol
CID 142760792
4-[(4-hydroxy-3,5-dimethylphenyl)disulfanyl]-2,6-dimethylphenol
CID 23361225
4-[3-(4-hydroxy-3,5-dimethylphenyl)phenyl]-2,6-dimethylphenol
CID 21020641
2,6-dimethyl-4-(4-phenylphenyl)phenol
CID 22900078
ethane;2,5,7-trimethylindazol-6-ol
CID 162433004

Frequently Asked Questions

What is the IUPAC name of 2-(4-hydroxy-3,5-dimethylphenyl)-1-methylimidazol-4-ol?
The IUPAC name of 2-(4-hydroxy-3,5-dimethylphenyl)-1-methylimidazol-4-ol (CID 136827210) is 2-(4-hydroxy-3,5-dimethylphenyl)-1-methylimidazol-4-ol.
What is the SMILES notation for 2-(4-hydroxy-3,5-dimethylphenyl)-1-methylimidazol-4-ol?
The canonical SMILES for 2-(4-hydroxy-3,5-dimethylphenyl)-1-methylimidazol-4-ol is Cc1cc(-c2nc(O)cn2C)cc(C)c1O.
What is the InChIKey of 2-(4-hydroxy-3,5-dimethylphenyl)-1-methylimidazol-4-ol?
The InChIKey is VORBRNXGYZMRJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2/c1-7-4-9(5-8(2)11(7)16)12-13-10(15)6-14(12)3/h4-6,15-16H,1-3H3.
What are the key properties of 2-(4-hydroxy-3,5-dimethylphenyl)-1-methylimidazol-4-ol?
2-(4-hydroxy-3,5-dimethylphenyl)-1-methylimidazol-4-ol has a molecular weight of 218.26 g/mol, XLogP of 2.12, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-hydroxy-3,5-dimethylphenyl)-1-methylimidazol-4-ol is sourced from PubChem (CID 136827210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).