2-(1-methylpyrazol-4-yl)oxypyridine

C9H9N3O — CID 117233488

IUPAC2-(1-methylpyrazol-4-yl)oxypyridine
SMILESCn1cc(Oc2ccccn2)cn1
InChIInChI=1S/C9H9N3O/c1-12-7-8(6-11-12)13-9-4-2-3-5-10-9/h2-7H,1H3
InChIKeyZHYPKYMPXRIROE-UHFFFAOYSA-N
MW175.19 g/mol
LogP1.61
Rot. Bonds2

About 2-(1-methylpyrazol-4-yl)oxypyridine

2-(1-methylpyrazol-4-yl)oxypyridine (PubChem CID 117233488) has the molecular formula C9H9N3O and a molecular weight of 175.19 g/mol. Its IUPAC name is 2-(1-methylpyrazol-4-yl)oxypyridine.

Molecular Properties

Compound Name2-(1-methylpyrazol-4-yl)oxypyridine
PubChem CID117233488
Molecular FormulaC9H9N3O
Molecular Weight175.19 g/mol
Exact Mass175.07
IUPAC Name2-(1-methylpyrazol-4-yl)oxypyridine
SMILESCn1cc(Oc2ccccn2)cn1
InChIInChI=1S/C9H9N3O/c1-12-7-8(6-11-12)13-9-4-2-3-5-10-9/h2-7H,1H3
InChIKeyZHYPKYMPXRIROE-UHFFFAOYSA-N
XLogP1.61
TPSA39.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.19
LogP ≤ 51.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(1-methylpyrazol-4-yl)oxypyridine?
The IUPAC name of 2-(1-methylpyrazol-4-yl)oxypyridine (CID 117233488) is 2-(1-methylpyrazol-4-yl)oxypyridine.
What is the SMILES notation for 2-(1-methylpyrazol-4-yl)oxypyridine?
The canonical SMILES for 2-(1-methylpyrazol-4-yl)oxypyridine is Cn1cc(Oc2ccccn2)cn1.
What is the InChIKey of 2-(1-methylpyrazol-4-yl)oxypyridine?
The InChIKey is ZHYPKYMPXRIROE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O/c1-12-7-8(6-11-12)13-9-4-2-3-5-10-9/h2-7H,1H3.
What are the key properties of 2-(1-methylpyrazol-4-yl)oxypyridine?
2-(1-methylpyrazol-4-yl)oxypyridine has a molecular weight of 175.19 g/mol, XLogP of 1.61, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylpyrazol-4-yl)oxypyridine is sourced from PubChem (CID 117233488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).