3-chloro-6-[5-(3-fluorophenyl)-3,6-dihydro-2H-pyridin-1-yl]pyridazine

C15H13ClFN3 — CID 19095525

IUPAC3-chloro-6-[5-(3-fluorophenyl)-3,6-dihydro-2H-pyridin-1-yl]pyridazine
SMILESFc1cccc(C2=CCCN(c3ccc(Cl)nn3)C2)c1
InChIInChI=1S/C15H13ClFN3/c16-14-6-7-15(19-18-14)20-8-2-4-12(10-20)11-3-1-5-13(17)9-11/h1,3-7,9H,2,8,10H2
InChIKeyQDVBFHHUAVPVKU-UHFFFAOYSA-N
MW289.74 g/mol
LogP3.56
Rot. Bonds2

About 3-chloro-6-[5-(3-fluorophenyl)-3,6-dihydro-2H-pyridin-1-yl]pyridazine

3-chloro-6-[5-(3-fluorophenyl)-3,6-dihydro-2H-pyridin-1-yl]pyridazine (PubChem CID 19095525) has the molecular formula C15H13ClFN3 and a molecular weight of 289.74 g/mol. Its IUPAC name is 3-chloro-6-[5-(3-fluorophenyl)-3,6-dihydro-2H-pyridin-1-yl]pyridazine.

Molecular Properties

Compound Name3-chloro-6-[5-(3-fluorophenyl)-3,6-dihydro-2H-pyridin-1-yl]pyridazine
PubChem CID19095525
Molecular FormulaC15H13ClFN3
Molecular Weight289.74 g/mol
Exact Mass289.08
IUPAC Name3-chloro-6-[5-(3-fluorophenyl)-3,6-dihydro-2H-pyridin-1-yl]pyridazine
SMILESFc1cccc(C2=CCCN(c3ccc(Cl)nn3)C2)c1
InChIInChI=1S/C15H13ClFN3/c16-14-6-7-15(19-18-14)20-8-2-4-12(10-20)11-3-1-5-13(17)9-11/h1,3-7,9H,2,8,10H2
InChIKeyQDVBFHHUAVPVKU-UHFFFAOYSA-N
XLogP3.56
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.74
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3-chloro-6-[5-(3-fluorophenyl)-3,6-dihydro-2H-pyridin-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-6-[5-(3-fluorophenyl)-3,6-dihydro-2H-pyridin-1-yl]pyridazine?
The IUPAC name of 3-chloro-6-[5-(3-fluorophenyl)-3,6-dihydro-2H-pyridin-1-yl]pyridazine (CID 19095525) is 3-chloro-6-[5-(3-fluorophenyl)-3,6-dihydro-2H-pyridin-1-yl]pyridazine.
What is the SMILES notation for 3-chloro-6-[5-(3-fluorophenyl)-3,6-dihydro-2H-pyridin-1-yl]pyridazine?
The canonical SMILES for 3-chloro-6-[5-(3-fluorophenyl)-3,6-dihydro-2H-pyridin-1-yl]pyridazine is Fc1cccc(C2=CCCN(c3ccc(Cl)nn3)C2)c1.
What is the InChIKey of 3-chloro-6-[5-(3-fluorophenyl)-3,6-dihydro-2H-pyridin-1-yl]pyridazine?
The InChIKey is QDVBFHHUAVPVKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClFN3/c16-14-6-7-15(19-18-14)20-8-2-4-12(10-20)11-3-1-5-13(17)9-11/h1,3-7,9H,2,8,10H2.
What are the key properties of 3-chloro-6-[5-(3-fluorophenyl)-3,6-dihydro-2H-pyridin-1-yl]pyridazine?
3-chloro-6-[5-(3-fluorophenyl)-3,6-dihydro-2H-pyridin-1-yl]pyridazine has a molecular weight of 289.74 g/mol, XLogP of 3.56, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-6-[5-(3-fluorophenyl)-3,6-dihydro-2H-pyridin-1-yl]pyridazine is sourced from PubChem (CID 19095525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).