2-[6-[2-[(2S)-pyrrolidin-2-yl]ethoxy]imidazo[1,2-b]pyridazin-3-yl]furo[3,2-c]pyridine

C19H19N5O2 — CID 71767597

IUPAC2-[6-[2-[(2S)-pyrrolidin-2-yl]ethoxy]imidazo[1,2-b]pyridazin-3-yl]furo[3,2-c]pyridine
SMILESc1cc2oc(-c3cnc4ccc(OCC[C@@H]5CCCN5)nn34)cc2cn1
InChIInChI=1S/C19H19N5O2/c1-2-14(21-7-1)6-9-25-19-4-3-18-22-12-15(24(18)23-19)17-10-13-11-20-8-5-16(13)26-17/h3-5,8,10-12,14,21H,1-2,6-7,9H2/t14-/m0/s1
InChIKeyQKFNKHFBSWHFSI-AWEZNQCLSA-N
MW349.39 g/mol
LogP3.06
Rot. Bonds5

About 2-[6-[2-[(2S)-pyrrolidin-2-yl]ethoxy]imidazo[1,2-b]pyridazin-3-yl]furo[3,2-c]pyridine

2-[6-[2-[(2S)-pyrrolidin-2-yl]ethoxy]imidazo[1,2-b]pyridazin-3-yl]furo[3,2-c]pyridine (PubChem CID 71767597) has the molecular formula C19H19N5O2 and a molecular weight of 349.39 g/mol. Its IUPAC name is 2-[6-[2-[(2S)-pyrrolidin-2-yl]ethoxy]imidazo[1,2-b]pyridazin-3-yl]furo[3,2-c]pyridine.

Molecular Properties

Compound Name2-[6-[2-[(2S)-pyrrolidin-2-yl]ethoxy]imidazo[1,2-b]pyridazin-3-yl]furo[3,2-c]pyridine
PubChem CID71767597
Molecular FormulaC19H19N5O2
Molecular Weight349.39 g/mol
Exact Mass349.15
IUPAC Name2-[6-[2-[(2S)-pyrrolidin-2-yl]ethoxy]imidazo[1,2-b]pyridazin-3-yl]furo[3,2-c]pyridine
SMILESc1cc2oc(-c3cnc4ccc(OCC[C@@H]5CCCN5)nn34)cc2cn1
InChIInChI=1S/C19H19N5O2/c1-2-14(21-7-1)6-9-25-19-4-3-18-22-12-15(24(18)23-19)17-10-13-11-20-8-5-16(13)26-17/h3-5,8,10-12,14,21H,1-2,6-7,9H2/t14-/m0/s1
InChIKeyQKFNKHFBSWHFSI-AWEZNQCLSA-N
XLogP3.06
TPSA77.48 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.39
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-[6-[2-[(2S)-pyrrolidin-2-yl]ethoxy]imidazo[1,2-b]pyridazin-3-yl]furo[3,2-c]pyridine?
The IUPAC name of 2-[6-[2-[(2S)-pyrrolidin-2-yl]ethoxy]imidazo[1,2-b]pyridazin-3-yl]furo[3,2-c]pyridine (CID 71767597) is 2-[6-[2-[(2S)-pyrrolidin-2-yl]ethoxy]imidazo[1,2-b]pyridazin-3-yl]furo[3,2-c]pyridine.
What is the SMILES notation for 2-[6-[2-[(2S)-pyrrolidin-2-yl]ethoxy]imidazo[1,2-b]pyridazin-3-yl]furo[3,2-c]pyridine?
The canonical SMILES for 2-[6-[2-[(2S)-pyrrolidin-2-yl]ethoxy]imidazo[1,2-b]pyridazin-3-yl]furo[3,2-c]pyridine is c1cc2oc(-c3cnc4ccc(OCC[C@@H]5CCCN5)nn34)cc2cn1.
What is the InChIKey of 2-[6-[2-[(2S)-pyrrolidin-2-yl]ethoxy]imidazo[1,2-b]pyridazin-3-yl]furo[3,2-c]pyridine?
The InChIKey is QKFNKHFBSWHFSI-AWEZNQCLSA-N. The full InChI is InChI=1S/C19H19N5O2/c1-2-14(21-7-1)6-9-25-19-4-3-18-22-12-15(24(18)23-19)17-10-13-11-20-8-5-16(13)26-17/h3-5,8,10-12,14,21H,1-2,6-7,9H2/t14-/m0/s1.
What are the key properties of 2-[6-[2-[(2S)-pyrrolidin-2-yl]ethoxy]imidazo[1,2-b]pyridazin-3-yl]furo[3,2-c]pyridine?
2-[6-[2-[(2S)-pyrrolidin-2-yl]ethoxy]imidazo[1,2-b]pyridazin-3-yl]furo[3,2-c]pyridine has a molecular weight of 349.39 g/mol, XLogP of 3.06, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-[2-[(2S)-pyrrolidin-2-yl]ethoxy]imidazo[1,2-b]pyridazin-3-yl]furo[3,2-c]pyridine is sourced from PubChem (CID 71767597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).