4-(4,5-diethyl-1H-imidazol-2-yl)-2,6-dimethoxyphenol

C15H20N2O3 — CID 154667076

IUPAC4-(4,5-diethyl-1H-imidazol-2-yl)-2,6-dimethoxyphenol
SMILESCCc1nc(-c2cc(OC)c(O)c(OC)c2)[nH]c1CC
InChIInChI=1S/C15H20N2O3/c1-5-10-11(6-2)17-15(16-10)9-7-12(19-3)14(18)13(8-9)20-4/h7-8,18H,5-6H2,1-4H3,(H,16,17)
InChIKeyUCGDFCFWKKNASU-UHFFFAOYSA-N
MW276.34 g/mol
LogP2.92
Rot. Bonds5

About 4-(4,5-diethyl-1H-imidazol-2-yl)-2,6-dimethoxyphenol

4-(4,5-diethyl-1H-imidazol-2-yl)-2,6-dimethoxyphenol (PubChem CID 154667076) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is 4-(4,5-diethyl-1H-imidazol-2-yl)-2,6-dimethoxyphenol.

Molecular Properties

Compound Name4-(4,5-diethyl-1H-imidazol-2-yl)-2,6-dimethoxyphenol
PubChem CID154667076
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC Name4-(4,5-diethyl-1H-imidazol-2-yl)-2,6-dimethoxyphenol
SMILESCCc1nc(-c2cc(OC)c(O)c(OC)c2)[nH]c1CC
InChIInChI=1S/C15H20N2O3/c1-5-10-11(6-2)17-15(16-10)9-7-12(19-3)14(18)13(8-9)20-4/h7-8,18H,5-6H2,1-4H3,(H,16,17)
InChIKeyUCGDFCFWKKNASU-UHFFFAOYSA-N
XLogP2.92
TPSA67.37 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(4,5-diethyl-1H-imidazol-2-yl)-2,6-dimethoxyphenol?
The IUPAC name of 4-(4,5-diethyl-1H-imidazol-2-yl)-2,6-dimethoxyphenol (CID 154667076) is 4-(4,5-diethyl-1H-imidazol-2-yl)-2,6-dimethoxyphenol.
What is the SMILES notation for 4-(4,5-diethyl-1H-imidazol-2-yl)-2,6-dimethoxyphenol?
The canonical SMILES for 4-(4,5-diethyl-1H-imidazol-2-yl)-2,6-dimethoxyphenol is CCc1nc(-c2cc(OC)c(O)c(OC)c2)[nH]c1CC.
What is the InChIKey of 4-(4,5-diethyl-1H-imidazol-2-yl)-2,6-dimethoxyphenol?
The InChIKey is UCGDFCFWKKNASU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3/c1-5-10-11(6-2)17-15(16-10)9-7-12(19-3)14(18)13(8-9)20-4/h7-8,18H,5-6H2,1-4H3,(H,16,17).
What are the key properties of 4-(4,5-diethyl-1H-imidazol-2-yl)-2,6-dimethoxyphenol?
4-(4,5-diethyl-1H-imidazol-2-yl)-2,6-dimethoxyphenol has a molecular weight of 276.34 g/mol, XLogP of 2.92, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4,5-diethyl-1H-imidazol-2-yl)-2,6-dimethoxyphenol is sourced from PubChem (CID 154667076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).