5-ethoxy-2-(5-methyl-4-pyridin-2-yl-1H-pyrazol-3-yl)phenol

C17H17N3O2 — CID 2374313

IUPAC5-ethoxy-2-(5-methyl-4-pyridin-2-yl-1H-pyrazol-3-yl)phenol
SMILESCCOc1ccc(-c2n[nH]c(C)c2-c2ccccn2)c(O)c1
InChIInChI=1S/C17H17N3O2/c1-3-22-12-7-8-13(15(21)10-12)17-16(11(2)19-20-17)14-6-4-5-9-18-14/h4-10,21H,3H2,1-2H3,(H,19,20)
InChIKeyYVYRHORAWUBTLH-UHFFFAOYSA-N
MW295.34 g/mol
LogP3.55
Rot. Bonds4

About 5-ethoxy-2-(5-methyl-4-pyridin-2-yl-1H-pyrazol-3-yl)phenol

5-ethoxy-2-(5-methyl-4-pyridin-2-yl-1H-pyrazol-3-yl)phenol (PubChem CID 2374313) has the molecular formula C17H17N3O2 and a molecular weight of 295.34 g/mol. Its IUPAC name is 5-ethoxy-2-(5-methyl-4-pyridin-2-yl-1H-pyrazol-3-yl)phenol.

Molecular Properties

Compound Name5-ethoxy-2-(5-methyl-4-pyridin-2-yl-1H-pyrazol-3-yl)phenol
PubChem CID2374313
Molecular FormulaC17H17N3O2
Molecular Weight295.34 g/mol
Exact Mass295.13
IUPAC Name5-ethoxy-2-(5-methyl-4-pyridin-2-yl-1H-pyrazol-3-yl)phenol
SMILESCCOc1ccc(-c2n[nH]c(C)c2-c2ccccn2)c(O)c1
InChIInChI=1S/C17H17N3O2/c1-3-22-12-7-8-13(15(21)10-12)17-16(11(2)19-20-17)14-6-4-5-9-18-14/h4-10,21H,3H2,1-2H3,(H,19,20)
InChIKeyYVYRHORAWUBTLH-UHFFFAOYSA-N
XLogP3.55
TPSA71.03 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.34
LogP ≤ 53.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-ethoxy-2-(5-methyl-4-pyridin-2-yl-1H-pyrazol-3-yl)phenol?
The IUPAC name of 5-ethoxy-2-(5-methyl-4-pyridin-2-yl-1H-pyrazol-3-yl)phenol (CID 2374313) is 5-ethoxy-2-(5-methyl-4-pyridin-2-yl-1H-pyrazol-3-yl)phenol.
What is the SMILES notation for 5-ethoxy-2-(5-methyl-4-pyridin-2-yl-1H-pyrazol-3-yl)phenol?
The canonical SMILES for 5-ethoxy-2-(5-methyl-4-pyridin-2-yl-1H-pyrazol-3-yl)phenol is CCOc1ccc(-c2n[nH]c(C)c2-c2ccccn2)c(O)c1.
What is the InChIKey of 5-ethoxy-2-(5-methyl-4-pyridin-2-yl-1H-pyrazol-3-yl)phenol?
The InChIKey is YVYRHORAWUBTLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O2/c1-3-22-12-7-8-13(15(21)10-12)17-16(11(2)19-20-17)14-6-4-5-9-18-14/h4-10,21H,3H2,1-2H3,(H,19,20).
What are the key properties of 5-ethoxy-2-(5-methyl-4-pyridin-2-yl-1H-pyrazol-3-yl)phenol?
5-ethoxy-2-(5-methyl-4-pyridin-2-yl-1H-pyrazol-3-yl)phenol has a molecular weight of 295.34 g/mol, XLogP of 3.55, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethoxy-2-(5-methyl-4-pyridin-2-yl-1H-pyrazol-3-yl)phenol is sourced from PubChem (CID 2374313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).