3-[4-(1H-pyrazol-5-yl)phenoxy]pyridine

C14H11N3O — CID 177376371

IUPAC3-[4-(1H-pyrazol-5-yl)phenoxy]pyridine
SMILESc1cncc(Oc2ccc(-c3ccn[nH]3)cc2)c1
InChIInChI=1S/C14H11N3O/c1-2-13(10-15-8-1)18-12-5-3-11(4-6-12)14-7-9-16-17-14/h1-10H,(H,16,17)
InChIKeyWCHAOYVYDPAKBH-UHFFFAOYSA-N
MW237.26 g/mol
LogP3.26
Rot. Bonds3

About 3-[4-(1H-pyrazol-5-yl)phenoxy]pyridine

3-[4-(1H-pyrazol-5-yl)phenoxy]pyridine (PubChem CID 177376371) has the molecular formula C14H11N3O and a molecular weight of 237.26 g/mol. Its IUPAC name is 3-[4-(1H-pyrazol-5-yl)phenoxy]pyridine.

Molecular Properties

Compound Name3-[4-(1H-pyrazol-5-yl)phenoxy]pyridine
PubChem CID177376371
Molecular FormulaC14H11N3O
Molecular Weight237.26 g/mol
Exact Mass237.09
IUPAC Name3-[4-(1H-pyrazol-5-yl)phenoxy]pyridine
SMILESc1cncc(Oc2ccc(-c3ccn[nH]3)cc2)c1
InChIInChI=1S/C14H11N3O/c1-2-13(10-15-8-1)18-12-5-3-11(4-6-12)14-7-9-16-17-14/h1-10H,(H,16,17)
InChIKeyWCHAOYVYDPAKBH-UHFFFAOYSA-N
XLogP3.26
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[4-(1H-pyrazol-5-yl)phenoxy]pyridine?
The IUPAC name of 3-[4-(1H-pyrazol-5-yl)phenoxy]pyridine (CID 177376371) is 3-[4-(1H-pyrazol-5-yl)phenoxy]pyridine.
What is the SMILES notation for 3-[4-(1H-pyrazol-5-yl)phenoxy]pyridine?
The canonical SMILES for 3-[4-(1H-pyrazol-5-yl)phenoxy]pyridine is c1cncc(Oc2ccc(-c3ccn[nH]3)cc2)c1.
What is the InChIKey of 3-[4-(1H-pyrazol-5-yl)phenoxy]pyridine?
The InChIKey is WCHAOYVYDPAKBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N3O/c1-2-13(10-15-8-1)18-12-5-3-11(4-6-12)14-7-9-16-17-14/h1-10H,(H,16,17).
What are the key properties of 3-[4-(1H-pyrazol-5-yl)phenoxy]pyridine?
3-[4-(1H-pyrazol-5-yl)phenoxy]pyridine has a molecular weight of 237.26 g/mol, XLogP of 3.26, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(1H-pyrazol-5-yl)phenoxy]pyridine is sourced from PubChem (CID 177376371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).