2-methoxy-4-(2,2,5-trimethylimidazol-4-yl)phenol

C13H16N2O2 — CID 136807960

IUPAC2-methoxy-4-(2,2,5-trimethylimidazol-4-yl)phenol
SMILESCOc1cc(C2=NC(C)(C)N=C2C)ccc1O
InChIInChI=1S/C13H16N2O2/c1-8-12(15-13(2,3)14-8)9-5-6-10(16)11(7-9)17-4/h5-7,16H,1-4H3
InChIKeyUBDFYAAYCZNGLQ-UHFFFAOYSA-N
MW232.28 g/mol
LogP2.40
Rot. Bonds2

About 2-methoxy-4-(2,2,5-trimethylimidazol-4-yl)phenol

2-methoxy-4-(2,2,5-trimethylimidazol-4-yl)phenol (PubChem CID 136807960) has the molecular formula C13H16N2O2 and a molecular weight of 232.28 g/mol. Its IUPAC name is 2-methoxy-4-(2,2,5-trimethylimidazol-4-yl)phenol.

Molecular Properties

Compound Name2-methoxy-4-(2,2,5-trimethylimidazol-4-yl)phenol
PubChem CID136807960
Molecular FormulaC13H16N2O2
Molecular Weight232.28 g/mol
Exact Mass232.12
IUPAC Name2-methoxy-4-(2,2,5-trimethylimidazol-4-yl)phenol
SMILESCOc1cc(C2=NC(C)(C)N=C2C)ccc1O
InChIInChI=1S/C13H16N2O2/c1-8-12(15-13(2,3)14-8)9-5-6-10(16)11(7-9)17-4/h5-7,16H,1-4H3
InChIKeyUBDFYAAYCZNGLQ-UHFFFAOYSA-N
XLogP2.40
TPSA54.18 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(3,5-dimethylphenyl)-2-methoxyphenol
CID 53220752
4-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methoxyphenol
CID 53220724
4-[4,5-dimethyl-6-(methylamino)pyrimidin-2-yl]-2-methoxyphenol
CID 135962121
4-(4-fluoro-3-methylphenyl)-2-methoxyphenol
CID 53220783
2-methoxy-4-(4-methoxy-2-methylphenyl)phenol
CID 53220857
2-(4-hydroxy-3-methoxyphenyl)-4-methyl-1,4-dihydroimidazol-5-one
CID 136827204
sodium;hydride;2-methoxy-4-methylphenol
CID 174706082
4-[3-(4-hydroxy-3-methoxyphenyl)benzo[g]quinoxalin-2-yl]-2-methoxyphenol
CID 1309066
4-[2,6-bis(4-aminophenyl)-4-pyridinyl]-2-methoxyphenol
CID 137136041
3-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-6,7-dimethylchromen-4-one
CID 56946608
6-(4-hydroxy-3-methoxyphenyl)naphthalen-1-ol
CID 56648216
2-methoxy-4-(4-methylsulfonylphenyl)phenol
CID 53221054

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-4-(2,2,5-trimethylimidazol-4-yl)phenol?
The IUPAC name of 2-methoxy-4-(2,2,5-trimethylimidazol-4-yl)phenol (CID 136807960) is 2-methoxy-4-(2,2,5-trimethylimidazol-4-yl)phenol.
What is the SMILES notation for 2-methoxy-4-(2,2,5-trimethylimidazol-4-yl)phenol?
The canonical SMILES for 2-methoxy-4-(2,2,5-trimethylimidazol-4-yl)phenol is COc1cc(C2=NC(C)(C)N=C2C)ccc1O.
What is the InChIKey of 2-methoxy-4-(2,2,5-trimethylimidazol-4-yl)phenol?
The InChIKey is UBDFYAAYCZNGLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O2/c1-8-12(15-13(2,3)14-8)9-5-6-10(16)11(7-9)17-4/h5-7,16H,1-4H3.
What are the key properties of 2-methoxy-4-(2,2,5-trimethylimidazol-4-yl)phenol?
2-methoxy-4-(2,2,5-trimethylimidazol-4-yl)phenol has a molecular weight of 232.28 g/mol, XLogP of 2.40, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4-(2,2,5-trimethylimidazol-4-yl)phenol is sourced from PubChem (CID 136807960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).