3-piperidin-1-yl-6-[4-[6-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyridazine

C19H23F3N6 — CID 166601439

IUPAC3-piperidin-1-yl-6-[4-[6-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyridazine
SMILESFC(F)(F)c1cccc(N2CCN(c3ccc(N4CCCCC4)nn3)CC2)n1
InChIInChI=1S/C19H23F3N6/c20-19(21,22)15-5-4-6-16(23-15)27-11-13-28(14-12-27)18-8-7-17(24-25-18)26-9-2-1-3-10-26/h4-8H,1-3,9-14H2
InChIKeyZICMYRARGRWWFS-UHFFFAOYSA-N
MW392.43 g/mol
LogP3.21
Rot. Bonds3

About 3-piperidin-1-yl-6-[4-[6-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyridazine

3-piperidin-1-yl-6-[4-[6-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyridazine (PubChem CID 166601439) has the molecular formula C19H23F3N6 and a molecular weight of 392.43 g/mol. Its IUPAC name is 3-piperidin-1-yl-6-[4-[6-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyridazine.

Molecular Properties

Compound Name3-piperidin-1-yl-6-[4-[6-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyridazine
PubChem CID166601439
Molecular FormulaC19H23F3N6
Molecular Weight392.43 g/mol
Exact Mass392.19
IUPAC Name3-piperidin-1-yl-6-[4-[6-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyridazine
SMILESFC(F)(F)c1cccc(N2CCN(c3ccc(N4CCCCC4)nn3)CC2)n1
InChIInChI=1S/C19H23F3N6/c20-19(21,22)15-5-4-6-16(23-15)27-11-13-28(14-12-27)18-8-7-17(24-25-18)26-9-2-1-3-10-26/h4-8H,1-3,9-14H2
InChIKeyZICMYRARGRWWFS-UHFFFAOYSA-N
XLogP3.21
TPSA48.39 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.43
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 3-piperidin-1-yl-6-[4-[6-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyridazine with MolForge

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

Launch Full Analysis

Related Compounds

4-(2-pyridinyl)-N-(2-pyridinylmethylene)-1-piperazinamine
CID 5336781
1-(6-Methylpyridin-2-yl)-4-(6-(4-phenylpiperazin-1-yl)hexyl)piperazine
CID 11604196
3-(4-Fluorophenyl)-4,5-dimethyl-6-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]pyridazine
CID 59191472
4,5-Dimethyl-3-phenyl-6-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]pyridazine
CID 59191490
3-[(4-Fluorophenyl)methyl]-4,5-dimethyl-6-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]pyridazine
CID 59191543
3-Benzyl-4,5-dimethyl-6-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]pyridazine
CID 59191563
4,5-Dimethyl-3-pyridin-4-yl-6-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]pyridazine
CID 59191586
5-Methyl-7-(4-(6-methylpyridin-2-yl)piperazin-1-yl)-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine
CID 4907583
1-(6-Methyl-2-pyridinyl)-4-(1-propylpiperidin-4-yl)piperazine
CID 28333735
N-methyl-1-(6-methylpyridazin-3-yl)-N-(pyridin-2-ylmethyl)piperidin-3-amine
CID 72043813
N-methyl-1-pyridazin-3-yl-N-(pyridin-2-ylmethyl)piperidin-3-amine
CID 72141151
3-(6-Methylpyridazin-3-yl)-9-(pyridin-2-ylmethyl)-3,9-diazaspiro[5.5]undecane
CID 97450325

Frequently Asked Questions

What is the IUPAC name of 3-piperidin-1-yl-6-[4-[6-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyridazine?
The IUPAC name of 3-piperidin-1-yl-6-[4-[6-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyridazine (CID 166601439) is 3-piperidin-1-yl-6-[4-[6-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyridazine.
What is the SMILES notation for 3-piperidin-1-yl-6-[4-[6-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyridazine?
The canonical SMILES for 3-piperidin-1-yl-6-[4-[6-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyridazine is FC(F)(F)c1cccc(N2CCN(c3ccc(N4CCCCC4)nn3)CC2)n1.
What is the InChIKey of 3-piperidin-1-yl-6-[4-[6-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyridazine?
The InChIKey is ZICMYRARGRWWFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23F3N6/c20-19(21,22)15-5-4-6-16(23-15)27-11-13-28(14-12-27)18-8-7-17(24-25-18)26-9-2-1-3-10-26/h4-8H,1-3,9-14H2.
What are the key properties of 3-piperidin-1-yl-6-[4-[6-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyridazine?
3-piperidin-1-yl-6-[4-[6-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyridazine has a molecular weight of 392.43 g/mol, XLogP of 3.21, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperidin-1-yl-6-[4-[6-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyridazine is sourced from PubChem (CID 166601439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).