6-(6-cyclopropylimidazo[1,2-b]pyridazin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine;difluoromethane

C19H22F2N6 — CID 164537196

IUPAC6-(6-cyclopropylimidazo[1,2-b]pyridazin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine;difluoromethane
SMILESFCF.c1cc(NC2CCNC2)nc(-c2cnc3ccc(C4CC4)nn23)c1
InChIInChI=1S/C18H20N6.CH2F2/c1-2-15(22-17(3-1)21-13-8-9-19-10-13)16-11-20-18-7-6-14(12-4-5-12)23-24(16)18;2-1-3/h1-3,6-7,11-13,19H,4-5,8-10H2,(H,21,22);1H2
InChIKeyARRXDSQQPHDCOT-UHFFFAOYSA-N
MW372.42 g/mol
LogP3.33
Rot. Bonds4

About 6-(6-cyclopropylimidazo[1,2-b]pyridazin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine;difluoromethane

6-(6-cyclopropylimidazo[1,2-b]pyridazin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine;difluoromethane (PubChem CID 164537196) has the molecular formula C19H22F2N6 and a molecular weight of 372.42 g/mol. Its IUPAC name is 6-(6-cyclopropylimidazo[1,2-b]pyridazin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine;difluoromethane.

Molecular Properties

Compound Name6-(6-cyclopropylimidazo[1,2-b]pyridazin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine;difluoromethane
PubChem CID164537196
Molecular FormulaC19H22F2N6
Molecular Weight372.42 g/mol
Exact Mass372.19
IUPAC Name6-(6-cyclopropylimidazo[1,2-b]pyridazin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine;difluoromethane
SMILESFCF.c1cc(NC2CCNC2)nc(-c2cnc3ccc(C4CC4)nn23)c1
InChIInChI=1S/C18H20N6.CH2F2/c1-2-15(22-17(3-1)21-13-8-9-19-10-13)16-11-20-18-7-6-14(12-4-5-12)23-24(16)18;2-1-3/h1-3,6-7,11-13,19H,4-5,8-10H2,(H,21,22);1H2
InChIKeyARRXDSQQPHDCOT-UHFFFAOYSA-N
XLogP3.33
TPSA67.14 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.42
LogP ≤ 53.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(6-cyclopropylimidazo[1,2-b]pyridazin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine;difluoromethane?
The IUPAC name of 6-(6-cyclopropylimidazo[1,2-b]pyridazin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine;difluoromethane (CID 164537196) is 6-(6-cyclopropylimidazo[1,2-b]pyridazin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine;difluoromethane.
What is the SMILES notation for 6-(6-cyclopropylimidazo[1,2-b]pyridazin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine;difluoromethane?
The canonical SMILES for 6-(6-cyclopropylimidazo[1,2-b]pyridazin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine;difluoromethane is FCF.c1cc(NC2CCNC2)nc(-c2cnc3ccc(C4CC4)nn23)c1.
What is the InChIKey of 6-(6-cyclopropylimidazo[1,2-b]pyridazin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine;difluoromethane?
The InChIKey is ARRXDSQQPHDCOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N6.CH2F2/c1-2-15(22-17(3-1)21-13-8-9-19-10-13)16-11-20-18-7-6-14(12-4-5-12)23-24(16)18;2-1-3/h1-3,6-7,11-13,19H,4-5,8-10H2,(H,21,22);1H2.
What are the key properties of 6-(6-cyclopropylimidazo[1,2-b]pyridazin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine;difluoromethane?
6-(6-cyclopropylimidazo[1,2-b]pyridazin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine;difluoromethane has a molecular weight of 372.42 g/mol, XLogP of 3.33, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(6-cyclopropylimidazo[1,2-b]pyridazin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine;difluoromethane is sourced from PubChem (CID 164537196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).