3-(2-chlorophenyl)-4-pyridin-4-ylpyridazine

C15H10ClN3 — CID 69275479

IUPAC3-(2-chlorophenyl)-4-pyridin-4-ylpyridazine
SMILESClc1ccccc1-c1nnccc1-c1ccncc1
InChIInChI=1S/C15H10ClN3/c16-14-4-2-1-3-13(14)15-12(7-10-18-19-15)11-5-8-17-9-6-11/h1-10H
InChIKeyHWSBBIRGIVNVHQ-UHFFFAOYSA-N
MW267.72 g/mol
LogP3.86
Rot. Bonds2

About 3-(2-chlorophenyl)-4-pyridin-4-ylpyridazine

3-(2-chlorophenyl)-4-pyridin-4-ylpyridazine (PubChem CID 69275479) has the molecular formula C15H10ClN3 and a molecular weight of 267.72 g/mol. Its IUPAC name is 3-(2-chlorophenyl)-4-pyridin-4-ylpyridazine.

Molecular Properties

Compound Name3-(2-chlorophenyl)-4-pyridin-4-ylpyridazine
PubChem CID69275479
Molecular FormulaC15H10ClN3
Molecular Weight267.72 g/mol
Exact Mass267.06
IUPAC Name3-(2-chlorophenyl)-4-pyridin-4-ylpyridazine
SMILESClc1ccccc1-c1nnccc1-c1ccncc1
InChIInChI=1S/C15H10ClN3/c16-14-4-2-1-3-13(14)15-12(7-10-18-19-15)11-5-8-17-9-6-11/h1-10H
InChIKeyHWSBBIRGIVNVHQ-UHFFFAOYSA-N
XLogP3.86
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.72
LogP ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(2-chlorophenyl)-4-pyridin-4-ylpyridazine?
The IUPAC name of 3-(2-chlorophenyl)-4-pyridin-4-ylpyridazine (CID 69275479) is 3-(2-chlorophenyl)-4-pyridin-4-ylpyridazine.
What is the SMILES notation for 3-(2-chlorophenyl)-4-pyridin-4-ylpyridazine?
The canonical SMILES for 3-(2-chlorophenyl)-4-pyridin-4-ylpyridazine is Clc1ccccc1-c1nnccc1-c1ccncc1.
What is the InChIKey of 3-(2-chlorophenyl)-4-pyridin-4-ylpyridazine?
The InChIKey is HWSBBIRGIVNVHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10ClN3/c16-14-4-2-1-3-13(14)15-12(7-10-18-19-15)11-5-8-17-9-6-11/h1-10H.
What are the key properties of 3-(2-chlorophenyl)-4-pyridin-4-ylpyridazine?
3-(2-chlorophenyl)-4-pyridin-4-ylpyridazine has a molecular weight of 267.72 g/mol, XLogP of 3.86, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-chlorophenyl)-4-pyridin-4-ylpyridazine is sourced from PubChem (CID 69275479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).