4-methoxy-2-(1-pyridin-2-ylpyrazol-3-yl)phenol

C15H13N3O2 — CID 135424610

IUPAC4-methoxy-2-(1-pyridin-2-ylpyrazol-3-yl)phenol
SMILESCOc1ccc(O)c(-c2ccn(-c3ccccn3)n2)c1
InChIInChI=1S/C15H13N3O2/c1-20-11-5-6-14(19)12(10-11)13-7-9-18(17-13)15-4-2-3-8-16-15/h2-10,19H,1H3
InChIKeyLGWRUXRBKCTJGC-UHFFFAOYSA-N
MW267.29 g/mol
LogP2.65
Rot. Bonds3

About 4-methoxy-2-(1-pyridin-2-ylpyrazol-3-yl)phenol

4-methoxy-2-(1-pyridin-2-ylpyrazol-3-yl)phenol (PubChem CID 135424610) has the molecular formula C15H13N3O2 and a molecular weight of 267.29 g/mol. Its IUPAC name is 4-methoxy-2-(1-pyridin-2-ylpyrazol-3-yl)phenol.

Molecular Properties

Compound Name4-methoxy-2-(1-pyridin-2-ylpyrazol-3-yl)phenol
PubChem CID135424610
Molecular FormulaC15H13N3O2
Molecular Weight267.29 g/mol
Exact Mass267.10
IUPAC Name4-methoxy-2-(1-pyridin-2-ylpyrazol-3-yl)phenol
SMILESCOc1ccc(O)c(-c2ccn(-c3ccccn3)n2)c1
InChIInChI=1S/C15H13N3O2/c1-20-11-5-6-14(19)12(10-11)13-7-9-18(17-13)15-4-2-3-8-16-15/h2-10,19H,1H3
InChIKeyLGWRUXRBKCTJGC-UHFFFAOYSA-N
XLogP2.65
TPSA60.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-(1-pyridin-2-ylpyrazol-3-yl)phenol?
The IUPAC name of 4-methoxy-2-(1-pyridin-2-ylpyrazol-3-yl)phenol (CID 135424610) is 4-methoxy-2-(1-pyridin-2-ylpyrazol-3-yl)phenol.
What is the SMILES notation for 4-methoxy-2-(1-pyridin-2-ylpyrazol-3-yl)phenol?
The canonical SMILES for 4-methoxy-2-(1-pyridin-2-ylpyrazol-3-yl)phenol is COc1ccc(O)c(-c2ccn(-c3ccccn3)n2)c1.
What is the InChIKey of 4-methoxy-2-(1-pyridin-2-ylpyrazol-3-yl)phenol?
The InChIKey is LGWRUXRBKCTJGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O2/c1-20-11-5-6-14(19)12(10-11)13-7-9-18(17-13)15-4-2-3-8-16-15/h2-10,19H,1H3.
What are the key properties of 4-methoxy-2-(1-pyridin-2-ylpyrazol-3-yl)phenol?
4-methoxy-2-(1-pyridin-2-ylpyrazol-3-yl)phenol has a molecular weight of 267.29 g/mol, XLogP of 2.65, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-(1-pyridin-2-ylpyrazol-3-yl)phenol is sourced from PubChem (CID 135424610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).