5-ethoxy-2-[4-(2-ethoxyphenoxy)-1H-pyrazol-5-yl]phenol

C19H20N2O4 — CID 664171

IUPAC5-ethoxy-2-[4-(2-ethoxyphenoxy)-1H-pyrazol-5-yl]phenol
SMILESCCOc1ccc(-c2[nH]ncc2Oc2ccccc2OCC)c(O)c1
InChIInChI=1S/C19H20N2O4/c1-3-23-13-9-10-14(15(22)11-13)19-18(12-20-21-19)25-17-8-6-5-7-16(17)24-4-2/h5-12,22H,3-4H2,1-2H3,(H,20,21)
InChIKeyWNVLPJAJNYJBFT-UHFFFAOYSA-N
MW340.38 g/mol
LogP4.37
Rot. Bonds7

About 5-ethoxy-2-[4-(2-ethoxyphenoxy)-1H-pyrazol-5-yl]phenol

5-ethoxy-2-[4-(2-ethoxyphenoxy)-1H-pyrazol-5-yl]phenol (PubChem CID 664171) has the molecular formula C19H20N2O4 and a molecular weight of 340.38 g/mol. Its IUPAC name is 5-ethoxy-2-[4-(2-ethoxyphenoxy)-1H-pyrazol-5-yl]phenol.

Molecular Properties

Compound Name5-ethoxy-2-[4-(2-ethoxyphenoxy)-1H-pyrazol-5-yl]phenol
PubChem CID664171
Molecular FormulaC19H20N2O4
Molecular Weight340.38 g/mol
Exact Mass340.14
IUPAC Name5-ethoxy-2-[4-(2-ethoxyphenoxy)-1H-pyrazol-5-yl]phenol
SMILESCCOc1ccc(-c2[nH]ncc2Oc2ccccc2OCC)c(O)c1
InChIInChI=1S/C19H20N2O4/c1-3-23-13-9-10-14(15(22)11-13)19-18(12-20-21-19)25-17-8-6-5-7-16(17)24-4-2/h5-12,22H,3-4H2,1-2H3,(H,20,21)
InChIKeyWNVLPJAJNYJBFT-UHFFFAOYSA-N
XLogP4.37
TPSA76.60 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 54.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5-ethoxy-2-[4-(2-ethoxyphenoxy)-1H-pyrazol-5-yl]phenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-ethoxy-2-[4-(2-ethoxyphenoxy)-1H-pyrazol-5-yl]phenol?
The IUPAC name of 5-ethoxy-2-[4-(2-ethoxyphenoxy)-1H-pyrazol-5-yl]phenol (CID 664171) is 5-ethoxy-2-[4-(2-ethoxyphenoxy)-1H-pyrazol-5-yl]phenol.
What is the SMILES notation for 5-ethoxy-2-[4-(2-ethoxyphenoxy)-1H-pyrazol-5-yl]phenol?
The canonical SMILES for 5-ethoxy-2-[4-(2-ethoxyphenoxy)-1H-pyrazol-5-yl]phenol is CCOc1ccc(-c2[nH]ncc2Oc2ccccc2OCC)c(O)c1.
What is the InChIKey of 5-ethoxy-2-[4-(2-ethoxyphenoxy)-1H-pyrazol-5-yl]phenol?
The InChIKey is WNVLPJAJNYJBFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O4/c1-3-23-13-9-10-14(15(22)11-13)19-18(12-20-21-19)25-17-8-6-5-7-16(17)24-4-2/h5-12,22H,3-4H2,1-2H3,(H,20,21).
What are the key properties of 5-ethoxy-2-[4-(2-ethoxyphenoxy)-1H-pyrazol-5-yl]phenol?
5-ethoxy-2-[4-(2-ethoxyphenoxy)-1H-pyrazol-5-yl]phenol has a molecular weight of 340.38 g/mol, XLogP of 4.37, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethoxy-2-[4-(2-ethoxyphenoxy)-1H-pyrazol-5-yl]phenol is sourced from PubChem (CID 664171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).