3-(6-fluoro-2-pyridinyl)-6-pyrrolidin-1-yl-2,3-dihydroimidazo[1,2-b]pyridazine

C15H16FN5 — CID 146410893

IUPAC3-(6-fluoro-2-pyridinyl)-6-pyrrolidin-1-yl-2,3-dihydroimidazo[1,2-b]pyridazine
SMILESFc1cccc(C2CN=C3C=CC(N4CCCC4)=NN32)n1
InChIInChI=1S/C15H16FN5/c16-13-5-3-4-11(18-13)12-10-17-14-6-7-15(19-21(12)14)20-8-1-2-9-20/h3-7,12H,1-2,8-10H2
InChIKeyVSGQIFIKEPHTIJ-UHFFFAOYSA-N
MW285.33 g/mol
LogP1.96
Rot. Bonds1

About 3-(6-fluoro-2-pyridinyl)-6-pyrrolidin-1-yl-2,3-dihydroimidazo[1,2-b]pyridazine

3-(6-fluoro-2-pyridinyl)-6-pyrrolidin-1-yl-2,3-dihydroimidazo[1,2-b]pyridazine (PubChem CID 146410893) has the molecular formula C15H16FN5 and a molecular weight of 285.33 g/mol. Its IUPAC name is 3-(6-fluoro-2-pyridinyl)-6-pyrrolidin-1-yl-2,3-dihydroimidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name3-(6-fluoro-2-pyridinyl)-6-pyrrolidin-1-yl-2,3-dihydroimidazo[1,2-b]pyridazine
PubChem CID146410893
Molecular FormulaC15H16FN5
Molecular Weight285.33 g/mol
Exact Mass285.14
IUPAC Name3-(6-fluoro-2-pyridinyl)-6-pyrrolidin-1-yl-2,3-dihydroimidazo[1,2-b]pyridazine
SMILESFc1cccc(C2CN=C3C=CC(N4CCCC4)=NN32)n1
InChIInChI=1S/C15H16FN5/c16-13-5-3-4-11(18-13)12-10-17-14-6-7-15(19-21(12)14)20-8-1-2-9-20/h3-7,12H,1-2,8-10H2
InChIKeyVSGQIFIKEPHTIJ-UHFFFAOYSA-N
XLogP1.96
TPSA44.09 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.33
LogP ≤ 51.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-(6-fluoro-2-pyridinyl)-6-pyrrolidin-1-yl-2,3-dihydroimidazo[1,2-b]pyridazine?
The IUPAC name of 3-(6-fluoro-2-pyridinyl)-6-pyrrolidin-1-yl-2,3-dihydroimidazo[1,2-b]pyridazine (CID 146410893) is 3-(6-fluoro-2-pyridinyl)-6-pyrrolidin-1-yl-2,3-dihydroimidazo[1,2-b]pyridazine.
What is the SMILES notation for 3-(6-fluoro-2-pyridinyl)-6-pyrrolidin-1-yl-2,3-dihydroimidazo[1,2-b]pyridazine?
The canonical SMILES for 3-(6-fluoro-2-pyridinyl)-6-pyrrolidin-1-yl-2,3-dihydroimidazo[1,2-b]pyridazine is Fc1cccc(C2CN=C3C=CC(N4CCCC4)=NN32)n1.
What is the InChIKey of 3-(6-fluoro-2-pyridinyl)-6-pyrrolidin-1-yl-2,3-dihydroimidazo[1,2-b]pyridazine?
The InChIKey is VSGQIFIKEPHTIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FN5/c16-13-5-3-4-11(18-13)12-10-17-14-6-7-15(19-21(12)14)20-8-1-2-9-20/h3-7,12H,1-2,8-10H2.
What are the key properties of 3-(6-fluoro-2-pyridinyl)-6-pyrrolidin-1-yl-2,3-dihydroimidazo[1,2-b]pyridazine?
3-(6-fluoro-2-pyridinyl)-6-pyrrolidin-1-yl-2,3-dihydroimidazo[1,2-b]pyridazine has a molecular weight of 285.33 g/mol, XLogP of 1.96, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-fluoro-2-pyridinyl)-6-pyrrolidin-1-yl-2,3-dihydroimidazo[1,2-b]pyridazine is sourced from PubChem (CID 146410893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).