4-(3-phenylpyrazol-1-yl)pyridine

C14H11N3 — CID 66015333

IUPAC4-(3-phenylpyrazol-1-yl)pyridine
SMILESc1ccc(-c2ccn(-c3ccncc3)n2)cc1
InChIInChI=1S/C14H11N3/c1-2-4-12(5-3-1)14-8-11-17(16-14)13-6-9-15-10-7-13/h1-11H
InChIKeyRCWQPOFTXGCZDY-UHFFFAOYSA-N
MW221.26 g/mol
LogP2.93
Rot. Bonds2

About 4-(3-phenylpyrazol-1-yl)pyridine

4-(3-phenylpyrazol-1-yl)pyridine (PubChem CID 66015333) has the molecular formula C14H11N3 and a molecular weight of 221.26 g/mol. Its IUPAC name is 4-(3-phenylpyrazol-1-yl)pyridine.

Molecular Properties

Compound Name4-(3-phenylpyrazol-1-yl)pyridine
PubChem CID66015333
Molecular FormulaC14H11N3
Molecular Weight221.26 g/mol
Exact Mass221.10
IUPAC Name4-(3-phenylpyrazol-1-yl)pyridine
SMILESc1ccc(-c2ccn(-c3ccncc3)n2)cc1
InChIInChI=1S/C14H11N3/c1-2-4-12(5-3-1)14-8-11-17(16-14)13-6-9-15-10-7-13/h1-11H
InChIKeyRCWQPOFTXGCZDY-UHFFFAOYSA-N
XLogP2.93
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(3-phenylpyrazol-1-yl)pyridine?
The IUPAC name of 4-(3-phenylpyrazol-1-yl)pyridine (CID 66015333) is 4-(3-phenylpyrazol-1-yl)pyridine.
What is the SMILES notation for 4-(3-phenylpyrazol-1-yl)pyridine?
The canonical SMILES for 4-(3-phenylpyrazol-1-yl)pyridine is c1ccc(-c2ccn(-c3ccncc3)n2)cc1.
What is the InChIKey of 4-(3-phenylpyrazol-1-yl)pyridine?
The InChIKey is RCWQPOFTXGCZDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N3/c1-2-4-12(5-3-1)14-8-11-17(16-14)13-6-9-15-10-7-13/h1-11H.
What are the key properties of 4-(3-phenylpyrazol-1-yl)pyridine?
4-(3-phenylpyrazol-1-yl)pyridine has a molecular weight of 221.26 g/mol, XLogP of 2.93, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-phenylpyrazol-1-yl)pyridine is sourced from PubChem (CID 66015333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).