2-methoxy-4-(1H-pyrazol-5-yl)pyridine

C9H9N3O — CID 130977878

IUPAC2-methoxy-4-(1H-pyrazol-5-yl)pyridine
SMILESCOc1cc(-c2ccn[nH]2)ccn1
InChIInChI=1S/C9H9N3O/c1-13-9-6-7(2-4-10-9)8-3-5-11-12-8/h2-6H,1H3,(H,11,12)
InChIKeyIJJKWHDVXVPFAX-UHFFFAOYSA-N
MW175.19 g/mol
LogP1.48
Rot. Bonds2

About 2-methoxy-4-(1H-pyrazol-5-yl)pyridine

2-methoxy-4-(1H-pyrazol-5-yl)pyridine (PubChem CID 130977878) has the molecular formula C9H9N3O and a molecular weight of 175.19 g/mol. Its IUPAC name is 2-methoxy-4-(1H-pyrazol-5-yl)pyridine.

Molecular Properties

Compound Name2-methoxy-4-(1H-pyrazol-5-yl)pyridine
PubChem CID130977878
Molecular FormulaC9H9N3O
Molecular Weight175.19 g/mol
Exact Mass175.07
IUPAC Name2-methoxy-4-(1H-pyrazol-5-yl)pyridine
SMILESCOc1cc(-c2ccn[nH]2)ccn1
InChIInChI=1S/C9H9N3O/c1-13-9-6-7(2-4-10-9)8-3-5-11-12-8/h2-6H,1H3,(H,11,12)
InChIKeyIJJKWHDVXVPFAX-UHFFFAOYSA-N
XLogP1.48
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.19
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-4-(1H-pyrazol-5-yl)pyridine?
The IUPAC name of 2-methoxy-4-(1H-pyrazol-5-yl)pyridine (CID 130977878) is 2-methoxy-4-(1H-pyrazol-5-yl)pyridine.
What is the SMILES notation for 2-methoxy-4-(1H-pyrazol-5-yl)pyridine?
The canonical SMILES for 2-methoxy-4-(1H-pyrazol-5-yl)pyridine is COc1cc(-c2ccn[nH]2)ccn1.
What is the InChIKey of 2-methoxy-4-(1H-pyrazol-5-yl)pyridine?
The InChIKey is IJJKWHDVXVPFAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O/c1-13-9-6-7(2-4-10-9)8-3-5-11-12-8/h2-6H,1H3,(H,11,12).
What are the key properties of 2-methoxy-4-(1H-pyrazol-5-yl)pyridine?
2-methoxy-4-(1H-pyrazol-5-yl)pyridine has a molecular weight of 175.19 g/mol, XLogP of 1.48, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4-(1H-pyrazol-5-yl)pyridine is sourced from PubChem (CID 130977878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).