4-(1H-pyrazol-5-yloxymethyl)pyridine

C9H9N3O — CID 164914774

IUPAC4-(1H-pyrazol-5-yloxymethyl)pyridine
SMILESc1cc(COc2ccn[nH]2)ccn1
InChIInChI=1S/C9H9N3O/c1-4-10-5-2-8(1)7-13-9-3-6-11-12-9/h1-6H,7H2,(H,11,12)
InChIKeyLZYKJTJKDWLVNG-UHFFFAOYSA-N
MW175.19 g/mol
LogP1.38
Rot. Bonds3

About 4-(1H-pyrazol-5-yloxymethyl)pyridine

4-(1H-pyrazol-5-yloxymethyl)pyridine (PubChem CID 164914774) has the molecular formula C9H9N3O and a molecular weight of 175.19 g/mol. Its IUPAC name is 4-(1H-pyrazol-5-yloxymethyl)pyridine.

Molecular Properties

Compound Name4-(1H-pyrazol-5-yloxymethyl)pyridine
PubChem CID164914774
Molecular FormulaC9H9N3O
Molecular Weight175.19 g/mol
Exact Mass175.07
IUPAC Name4-(1H-pyrazol-5-yloxymethyl)pyridine
SMILESc1cc(COc2ccn[nH]2)ccn1
InChIInChI=1S/C9H9N3O/c1-4-10-5-2-8(1)7-13-9-3-6-11-12-9/h1-6H,7H2,(H,11,12)
InChIKeyLZYKJTJKDWLVNG-UHFFFAOYSA-N
XLogP1.38
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.19
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(1H-pyrazol-5-yloxymethyl)pyridine?
The IUPAC name of 4-(1H-pyrazol-5-yloxymethyl)pyridine (CID 164914774) is 4-(1H-pyrazol-5-yloxymethyl)pyridine.
What is the SMILES notation for 4-(1H-pyrazol-5-yloxymethyl)pyridine?
The canonical SMILES for 4-(1H-pyrazol-5-yloxymethyl)pyridine is c1cc(COc2ccn[nH]2)ccn1.
What is the InChIKey of 4-(1H-pyrazol-5-yloxymethyl)pyridine?
The InChIKey is LZYKJTJKDWLVNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O/c1-4-10-5-2-8(1)7-13-9-3-6-11-12-9/h1-6H,7H2,(H,11,12).
What are the key properties of 4-(1H-pyrazol-5-yloxymethyl)pyridine?
4-(1H-pyrazol-5-yloxymethyl)pyridine has a molecular weight of 175.19 g/mol, XLogP of 1.38, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1H-pyrazol-5-yloxymethyl)pyridine is sourced from PubChem (CID 164914774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).