3-[2-(furan-3-yl)-4-pyridinyl]-7-pyridin-4-ylimidazo[1,2-b]pyridazine

C20H13N5O — CID 25176220

IUPAC3-[2-(furan-3-yl)-4-pyridinyl]-7-pyridin-4-ylimidazo[1,2-b]pyridazine
SMILESc1cc(-c2cnn3c(-c4ccnc(-c5ccoc5)c4)cnc3c2)ccn1
InChIInChI=1S/C20H13N5O/c1-5-21-6-2-14(1)17-10-20-23-12-19(25(20)24-11-17)15-3-7-22-18(9-15)16-4-8-26-13-16/h1-13H
InChIKeyGUEGYFLSMHMQKG-UHFFFAOYSA-N
MW339.36 g/mol
LogP4.11
Rot. Bonds3

About 3-[2-(furan-3-yl)-4-pyridinyl]-7-pyridin-4-ylimidazo[1,2-b]pyridazine

3-[2-(furan-3-yl)-4-pyridinyl]-7-pyridin-4-ylimidazo[1,2-b]pyridazine (PubChem CID 25176220) has the molecular formula C20H13N5O and a molecular weight of 339.36 g/mol. Its IUPAC name is 3-[2-(furan-3-yl)-4-pyridinyl]-7-pyridin-4-ylimidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name3-[2-(furan-3-yl)-4-pyridinyl]-7-pyridin-4-ylimidazo[1,2-b]pyridazine
PubChem CID25176220
Molecular FormulaC20H13N5O
Molecular Weight339.36 g/mol
Exact Mass339.11
IUPAC Name3-[2-(furan-3-yl)-4-pyridinyl]-7-pyridin-4-ylimidazo[1,2-b]pyridazine
SMILESc1cc(-c2cnn3c(-c4ccnc(-c5ccoc5)c4)cnc3c2)ccn1
InChIInChI=1S/C20H13N5O/c1-5-21-6-2-14(1)17-10-20-23-12-19(25(20)24-11-17)15-3-7-22-18(9-15)16-4-8-26-13-16/h1-13H
InChIKeyGUEGYFLSMHMQKG-UHFFFAOYSA-N
XLogP4.11
TPSA69.11 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.36
LogP ≤ 54.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-[2-(furan-3-yl)-4-pyridinyl]-7-pyridin-4-ylimidazo[1,2-b]pyridazine?
The IUPAC name of 3-[2-(furan-3-yl)-4-pyridinyl]-7-pyridin-4-ylimidazo[1,2-b]pyridazine (CID 25176220) is 3-[2-(furan-3-yl)-4-pyridinyl]-7-pyridin-4-ylimidazo[1,2-b]pyridazine.
What is the SMILES notation for 3-[2-(furan-3-yl)-4-pyridinyl]-7-pyridin-4-ylimidazo[1,2-b]pyridazine?
The canonical SMILES for 3-[2-(furan-3-yl)-4-pyridinyl]-7-pyridin-4-ylimidazo[1,2-b]pyridazine is c1cc(-c2cnn3c(-c4ccnc(-c5ccoc5)c4)cnc3c2)ccn1.
What is the InChIKey of 3-[2-(furan-3-yl)-4-pyridinyl]-7-pyridin-4-ylimidazo[1,2-b]pyridazine?
The InChIKey is GUEGYFLSMHMQKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H13N5O/c1-5-21-6-2-14(1)17-10-20-23-12-19(25(20)24-11-17)15-3-7-22-18(9-15)16-4-8-26-13-16/h1-13H.
What are the key properties of 3-[2-(furan-3-yl)-4-pyridinyl]-7-pyridin-4-ylimidazo[1,2-b]pyridazine?
3-[2-(furan-3-yl)-4-pyridinyl]-7-pyridin-4-ylimidazo[1,2-b]pyridazine has a molecular weight of 339.36 g/mol, XLogP of 4.11, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(furan-3-yl)-4-pyridinyl]-7-pyridin-4-ylimidazo[1,2-b]pyridazine is sourced from PubChem (CID 25176220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).