2-(2-methoxyphenyl)-1-(1,3,5-trimethylpyrazol-4-yl)ethanol

C15H20N2O2 — CID 105081597

IUPAC2-(2-methoxyphenyl)-1-(1,3,5-trimethylpyrazol-4-yl)ethanol
SMILESCOc1ccccc1CC(O)c1c(C)nn(C)c1C
InChIInChI=1S/C15H20N2O2/c1-10-15(11(2)17(3)16-10)13(18)9-12-7-5-6-8-14(12)19-4/h5-8,13,18H,9H2,1-4H3
InChIKeyXSBZPUTTZCAVOE-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.32
Rot. Bonds4

About 2-(2-methoxyphenyl)-1-(1,3,5-trimethylpyrazol-4-yl)ethanol

2-(2-methoxyphenyl)-1-(1,3,5-trimethylpyrazol-4-yl)ethanol (PubChem CID 105081597) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 2-(2-methoxyphenyl)-1-(1,3,5-trimethylpyrazol-4-yl)ethanol.

Molecular Properties

Compound Name2-(2-methoxyphenyl)-1-(1,3,5-trimethylpyrazol-4-yl)ethanol
PubChem CID105081597
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name2-(2-methoxyphenyl)-1-(1,3,5-trimethylpyrazol-4-yl)ethanol
SMILESCOc1ccccc1CC(O)c1c(C)nn(C)c1C
InChIInChI=1S/C15H20N2O2/c1-10-15(11(2)17(3)16-10)13(18)9-12-7-5-6-8-14(12)19-4/h5-8,13,18H,9H2,1-4H3
InChIKeyXSBZPUTTZCAVOE-UHFFFAOYSA-N
XLogP2.32
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-methoxy-5-methylphenyl)-1-(1,3,5-trimethylpyrazol-4-yl)ethanol
CID 105083651
1-(2,6-dimethoxyphenyl)-2-(2-methoxyphenyl)ethanol
CID 63018829
(2R)-N-[(2-methoxyphenyl)methyl]-2-(1,3,5-trimethylpyrazol-4-yl)propanamide
CID 94796021
2-(4-iodophenyl)-1-(1,3,5-trimethylpyrazol-4-yl)ethanol
CID 105101093
2-(4-chlorophenyl)-1-(1,3,5-trimethylpyrazol-4-yl)ethanol
CID 105076709
(2-fluoro-3-methoxyphenyl)-(1,3,5-trimethylpyrazol-4-yl)methanol
CID 105121006
2-(2-methoxyphenyl)-1-(3-propan-2-ylimidazol-4-yl)ethanol
CID 66162236
(2-ethoxyphenyl)-(1,3,5-trimethylpyrazol-4-yl)methanol
CID 105095910
2-(2-methoxyphenyl)-1-(4-methyl-3-pyridinyl)ethanol
CID 66272470
2-(3,4-dichlorophenyl)-1-(1,3,5-trimethylpyrazol-4-yl)ethanol
CID 105088082
2-(2-methoxyphenyl)-1-(3-propyltriazol-4-yl)ethanol
CID 114686339
(2R)-1-(2-methoxyphenyl)propan-2-ol
CID 6951555

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenyl)-1-(1,3,5-trimethylpyrazol-4-yl)ethanol?
The IUPAC name of 2-(2-methoxyphenyl)-1-(1,3,5-trimethylpyrazol-4-yl)ethanol (CID 105081597) is 2-(2-methoxyphenyl)-1-(1,3,5-trimethylpyrazol-4-yl)ethanol.
What is the SMILES notation for 2-(2-methoxyphenyl)-1-(1,3,5-trimethylpyrazol-4-yl)ethanol?
The canonical SMILES for 2-(2-methoxyphenyl)-1-(1,3,5-trimethylpyrazol-4-yl)ethanol is COc1ccccc1CC(O)c1c(C)nn(C)c1C.
What is the InChIKey of 2-(2-methoxyphenyl)-1-(1,3,5-trimethylpyrazol-4-yl)ethanol?
The InChIKey is XSBZPUTTZCAVOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-10-15(11(2)17(3)16-10)13(18)9-12-7-5-6-8-14(12)19-4/h5-8,13,18H,9H2,1-4H3.
What are the key properties of 2-(2-methoxyphenyl)-1-(1,3,5-trimethylpyrazol-4-yl)ethanol?
2-(2-methoxyphenyl)-1-(1,3,5-trimethylpyrazol-4-yl)ethanol has a molecular weight of 260.34 g/mol, XLogP of 2.32, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenyl)-1-(1,3,5-trimethylpyrazol-4-yl)ethanol is sourced from PubChem (CID 105081597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).