2-pyridin-2-ylindazole

C12H9N3 — CID 58814039

IUPAC2-pyridin-2-ylindazole
SMILESc1ccc(-n2cc3ccccc3n2)nc1
InChIInChI=1S/C12H9N3/c1-2-6-11-10(5-1)9-15(14-11)12-7-3-4-8-13-12/h1-9H
InChIKeyCDWMERFUIJAQCO-UHFFFAOYSA-N
MW195.22 g/mol
LogP2.42
Rot. Bonds1

About 2-pyridin-2-ylindazole

2-pyridin-2-ylindazole (PubChem CID 58814039) has the molecular formula C12H9N3 and a molecular weight of 195.22 g/mol. Its IUPAC name is 2-pyridin-2-ylindazole.

Molecular Properties

Compound Name2-pyridin-2-ylindazole
PubChem CID58814039
Molecular FormulaC12H9N3
Molecular Weight195.22 g/mol
Exact Mass195.08
IUPAC Name2-pyridin-2-ylindazole
SMILESc1ccc(-n2cc3ccccc3n2)nc1
InChIInChI=1S/C12H9N3/c1-2-6-11-10(5-1)9-15(14-11)12-7-3-4-8-13-12/h1-9H
InChIKeyCDWMERFUIJAQCO-UHFFFAOYSA-N
XLogP2.42
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-pyridin-2-ylindazole?
The IUPAC name of 2-pyridin-2-ylindazole (CID 58814039) is 2-pyridin-2-ylindazole.
What is the SMILES notation for 2-pyridin-2-ylindazole?
The canonical SMILES for 2-pyridin-2-ylindazole is c1ccc(-n2cc3ccccc3n2)nc1.
What is the InChIKey of 2-pyridin-2-ylindazole?
The InChIKey is CDWMERFUIJAQCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9N3/c1-2-6-11-10(5-1)9-15(14-11)12-7-3-4-8-13-12/h1-9H.
What are the key properties of 2-pyridin-2-ylindazole?
2-pyridin-2-ylindazole has a molecular weight of 195.22 g/mol, XLogP of 2.42, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyridin-2-ylindazole is sourced from PubChem (CID 58814039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).