3-chloro-5-(4,4-difluoropiperidin-1-yl)pyridazine

C9H10ClF2N3 — CID 164644524

IUPAC3-chloro-5-(4,4-difluoropiperidin-1-yl)pyridazine
SMILESFC1(F)CCN(c2cnnc(Cl)c2)CC1
InChIInChI=1S/C9H10ClF2N3/c10-8-5-7(6-13-14-8)15-3-1-9(11,12)2-4-15/h5-6H,1-4H2
InChIKeyUISRLXUUKLFKMS-UHFFFAOYSA-N
MW233.65 g/mol
LogP2.37
Rot. Bonds1

About 3-chloro-5-(4,4-difluoropiperidin-1-yl)pyridazine

3-chloro-5-(4,4-difluoropiperidin-1-yl)pyridazine (PubChem CID 164644524) has the molecular formula C9H10ClF2N3 and a molecular weight of 233.65 g/mol. Its IUPAC name is 3-chloro-5-(4,4-difluoropiperidin-1-yl)pyridazine.

Molecular Properties

Compound Name3-chloro-5-(4,4-difluoropiperidin-1-yl)pyridazine
PubChem CID164644524
Molecular FormulaC9H10ClF2N3
Molecular Weight233.65 g/mol
Exact Mass233.05
IUPAC Name3-chloro-5-(4,4-difluoropiperidin-1-yl)pyridazine
SMILESFC1(F)CCN(c2cnnc(Cl)c2)CC1
InChIInChI=1S/C9H10ClF2N3/c10-8-5-7(6-13-14-8)15-3-1-9(11,12)2-4-15/h5-6H,1-4H2
InChIKeyUISRLXUUKLFKMS-UHFFFAOYSA-N
XLogP2.37
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.65
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3-chloro-5-(4,4-difluoropiperidin-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

Frequently Asked Questions

What is the IUPAC name of 3-chloro-5-(4,4-difluoropiperidin-1-yl)pyridazine?
The IUPAC name of 3-chloro-5-(4,4-difluoropiperidin-1-yl)pyridazine (CID 164644524) is 3-chloro-5-(4,4-difluoropiperidin-1-yl)pyridazine.
What is the SMILES notation for 3-chloro-5-(4,4-difluoropiperidin-1-yl)pyridazine?
The canonical SMILES for 3-chloro-5-(4,4-difluoropiperidin-1-yl)pyridazine is FC1(F)CCN(c2cnnc(Cl)c2)CC1.
What is the InChIKey of 3-chloro-5-(4,4-difluoropiperidin-1-yl)pyridazine?
The InChIKey is UISRLXUUKLFKMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10ClF2N3/c10-8-5-7(6-13-14-8)15-3-1-9(11,12)2-4-15/h5-6H,1-4H2.
What are the key properties of 3-chloro-5-(4,4-difluoropiperidin-1-yl)pyridazine?
3-chloro-5-(4,4-difluoropiperidin-1-yl)pyridazine has a molecular weight of 233.65 g/mol, XLogP of 2.37, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-5-(4,4-difluoropiperidin-1-yl)pyridazine is sourced from PubChem (CID 164644524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).