2-[3-(1-methyl-3-pyridin-3-ylpyrazol-5-yl)pyrazol-1-yl]pyridine

C17H14N6 — CID 58416035

IUPAC2-[3-(1-methyl-3-pyridin-3-ylpyrazol-5-yl)pyrazol-1-yl]pyridine
SMILESCn1nc(-c2cccnc2)cc1-c1ccn(-c2ccccn2)n1
InChIInChI=1S/C17H14N6/c1-22-16(11-15(20-22)13-5-4-8-18-12-13)14-7-10-23(21-14)17-6-2-3-9-19-17/h2-12H,1H3
InChIKeyBEJVZUQMQLHDDE-UHFFFAOYSA-N
MW302.34 g/mol
LogP2.73
Rot. Bonds3

About 2-[3-(1-methyl-3-pyridin-3-ylpyrazol-5-yl)pyrazol-1-yl]pyridine

2-[3-(1-methyl-3-pyridin-3-ylpyrazol-5-yl)pyrazol-1-yl]pyridine (PubChem CID 58416035) has the molecular formula C17H14N6 and a molecular weight of 302.34 g/mol. Its IUPAC name is 2-[3-(1-methyl-3-pyridin-3-ylpyrazol-5-yl)pyrazol-1-yl]pyridine.

Molecular Properties

Compound Name2-[3-(1-methyl-3-pyridin-3-ylpyrazol-5-yl)pyrazol-1-yl]pyridine
PubChem CID58416035
Molecular FormulaC17H14N6
Molecular Weight302.34 g/mol
Exact Mass302.13
IUPAC Name2-[3-(1-methyl-3-pyridin-3-ylpyrazol-5-yl)pyrazol-1-yl]pyridine
SMILESCn1nc(-c2cccnc2)cc1-c1ccn(-c2ccccn2)n1
InChIInChI=1S/C17H14N6/c1-22-16(11-15(20-22)13-5-4-8-18-12-13)14-7-10-23(21-14)17-6-2-3-9-19-17/h2-12H,1H3
InChIKeyBEJVZUQMQLHDDE-UHFFFAOYSA-N
XLogP2.73
TPSA61.42 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.34
LogP ≤ 52.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-[3-(1-methyl-3-pyridin-3-ylpyrazol-5-yl)pyrazol-1-yl]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[3-(1-methyl-3-pyridin-3-ylpyrazol-5-yl)pyrazol-1-yl]pyridine?
The IUPAC name of 2-[3-(1-methyl-3-pyridin-3-ylpyrazol-5-yl)pyrazol-1-yl]pyridine (CID 58416035) is 2-[3-(1-methyl-3-pyridin-3-ylpyrazol-5-yl)pyrazol-1-yl]pyridine.
What is the SMILES notation for 2-[3-(1-methyl-3-pyridin-3-ylpyrazol-5-yl)pyrazol-1-yl]pyridine?
The canonical SMILES for 2-[3-(1-methyl-3-pyridin-3-ylpyrazol-5-yl)pyrazol-1-yl]pyridine is Cn1nc(-c2cccnc2)cc1-c1ccn(-c2ccccn2)n1.
What is the InChIKey of 2-[3-(1-methyl-3-pyridin-3-ylpyrazol-5-yl)pyrazol-1-yl]pyridine?
The InChIKey is BEJVZUQMQLHDDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N6/c1-22-16(11-15(20-22)13-5-4-8-18-12-13)14-7-10-23(21-14)17-6-2-3-9-19-17/h2-12H,1H3.
What are the key properties of 2-[3-(1-methyl-3-pyridin-3-ylpyrazol-5-yl)pyrazol-1-yl]pyridine?
2-[3-(1-methyl-3-pyridin-3-ylpyrazol-5-yl)pyrazol-1-yl]pyridine has a molecular weight of 302.34 g/mol, XLogP of 2.73, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(1-methyl-3-pyridin-3-ylpyrazol-5-yl)pyrazol-1-yl]pyridine is sourced from PubChem (CID 58416035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).