6-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-b]pyridazine-3-carboxamide

C11H11F2N5O — CID 126709205

IUPAC6-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-b]pyridazine-3-carboxamide
SMILESNC(=O)c1cnc2ccc(N3CCC(F)(F)C3)nn12
InChIInChI=1S/C11H11F2N5O/c12-11(13)3-4-17(6-11)9-2-1-8-15-5-7(10(14)19)18(8)16-9/h1-2,5H,3-4,6H2,(H2,14,19)
InChIKeyUVZKFNCOGKHSQM-UHFFFAOYSA-N
MW267.24 g/mol
LogP0.67
Rot. Bonds2

About 6-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-b]pyridazine-3-carboxamide

6-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-b]pyridazine-3-carboxamide (PubChem CID 126709205) has the molecular formula C11H11F2N5O and a molecular weight of 267.24 g/mol. Its IUPAC name is 6-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-b]pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-b]pyridazine-3-carboxamide
PubChem CID126709205
Molecular FormulaC11H11F2N5O
Molecular Weight267.24 g/mol
Exact Mass267.09
IUPAC Name6-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-b]pyridazine-3-carboxamide
SMILESNC(=O)c1cnc2ccc(N3CCC(F)(F)C3)nn12
InChIInChI=1S/C11H11F2N5O/c12-11(13)3-4-17(6-11)9-2-1-8-15-5-7(10(14)19)18(8)16-9/h1-2,5H,3-4,6H2,(H2,14,19)
InChIKeyUVZKFNCOGKHSQM-UHFFFAOYSA-N
XLogP0.67
TPSA76.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.24
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-b]pyridazine-3-carboxamide?
The IUPAC name of 6-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-b]pyridazine-3-carboxamide (CID 126709205) is 6-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-b]pyridazine-3-carboxamide.
What is the SMILES notation for 6-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-b]pyridazine-3-carboxamide?
The canonical SMILES for 6-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-b]pyridazine-3-carboxamide is NC(=O)c1cnc2ccc(N3CCC(F)(F)C3)nn12.
What is the InChIKey of 6-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-b]pyridazine-3-carboxamide?
The InChIKey is UVZKFNCOGKHSQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11F2N5O/c12-11(13)3-4-17(6-11)9-2-1-8-15-5-7(10(14)19)18(8)16-9/h1-2,5H,3-4,6H2,(H2,14,19).
What are the key properties of 6-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-b]pyridazine-3-carboxamide?
6-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-b]pyridazine-3-carboxamide has a molecular weight of 267.24 g/mol, XLogP of 0.67, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-b]pyridazine-3-carboxamide is sourced from PubChem (CID 126709205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).