4-[3-[6-(3,6-dihydro-2H-pyran-4-yl)-3-pyridinyl]-2-methylimidazo[1,2-b]pyridazin-8-yl]morpholine

C21H23N5O2 — CID 58496276

IUPAC4-[3-[6-(3,6-dihydro-2H-pyran-4-yl)-3-pyridinyl]-2-methylimidazo[1,2-b]pyridazin-8-yl]morpholine
SMILESCc1nc2c(N3CCOCC3)ccnn2c1-c1ccc(C2=CCOCC2)nc1
InChIInChI=1S/C21H23N5O2/c1-15-20(17-2-3-18(22-14-17)16-5-10-27-11-6-16)26-21(24-15)19(4-7-23-26)25-8-12-28-13-9-25/h2-5,7,14H,6,8-13H2,1H3
InChIKeyUOXCACBMDPDDQP-UHFFFAOYSA-N
MW377.45 g/mol
LogP2.74
Rot. Bonds3

About 4-[3-[6-(3,6-dihydro-2H-pyran-4-yl)-3-pyridinyl]-2-methylimidazo[1,2-b]pyridazin-8-yl]morpholine

4-[3-[6-(3,6-dihydro-2H-pyran-4-yl)-3-pyridinyl]-2-methylimidazo[1,2-b]pyridazin-8-yl]morpholine (PubChem CID 58496276) has the molecular formula C21H23N5O2 and a molecular weight of 377.45 g/mol. Its IUPAC name is 4-[3-[6-(3,6-dihydro-2H-pyran-4-yl)-3-pyridinyl]-2-methylimidazo[1,2-b]pyridazin-8-yl]morpholine.

Molecular Properties

Compound Name4-[3-[6-(3,6-dihydro-2H-pyran-4-yl)-3-pyridinyl]-2-methylimidazo[1,2-b]pyridazin-8-yl]morpholine
PubChem CID58496276
Molecular FormulaC21H23N5O2
Molecular Weight377.45 g/mol
Exact Mass377.19
IUPAC Name4-[3-[6-(3,6-dihydro-2H-pyran-4-yl)-3-pyridinyl]-2-methylimidazo[1,2-b]pyridazin-8-yl]morpholine
SMILESCc1nc2c(N3CCOCC3)ccnn2c1-c1ccc(C2=CCOCC2)nc1
InChIInChI=1S/C21H23N5O2/c1-15-20(17-2-3-18(22-14-17)16-5-10-27-11-6-16)26-21(24-15)19(4-7-23-26)25-8-12-28-13-9-25/h2-5,7,14H,6,8-13H2,1H3
InChIKeyUOXCACBMDPDDQP-UHFFFAOYSA-N
XLogP2.74
TPSA64.78 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.45
LogP ≤ 52.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-[3-[6-(3,6-dihydro-2H-pyran-4-yl)-3-pyridinyl]-2-methylimidazo[1,2-b]pyridazin-8-yl]morpholine?
The IUPAC name of 4-[3-[6-(3,6-dihydro-2H-pyran-4-yl)-3-pyridinyl]-2-methylimidazo[1,2-b]pyridazin-8-yl]morpholine (CID 58496276) is 4-[3-[6-(3,6-dihydro-2H-pyran-4-yl)-3-pyridinyl]-2-methylimidazo[1,2-b]pyridazin-8-yl]morpholine.
What is the SMILES notation for 4-[3-[6-(3,6-dihydro-2H-pyran-4-yl)-3-pyridinyl]-2-methylimidazo[1,2-b]pyridazin-8-yl]morpholine?
The canonical SMILES for 4-[3-[6-(3,6-dihydro-2H-pyran-4-yl)-3-pyridinyl]-2-methylimidazo[1,2-b]pyridazin-8-yl]morpholine is Cc1nc2c(N3CCOCC3)ccnn2c1-c1ccc(C2=CCOCC2)nc1.
What is the InChIKey of 4-[3-[6-(3,6-dihydro-2H-pyran-4-yl)-3-pyridinyl]-2-methylimidazo[1,2-b]pyridazin-8-yl]morpholine?
The InChIKey is UOXCACBMDPDDQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N5O2/c1-15-20(17-2-3-18(22-14-17)16-5-10-27-11-6-16)26-21(24-15)19(4-7-23-26)25-8-12-28-13-9-25/h2-5,7,14H,6,8-13H2,1H3.
What are the key properties of 4-[3-[6-(3,6-dihydro-2H-pyran-4-yl)-3-pyridinyl]-2-methylimidazo[1,2-b]pyridazin-8-yl]morpholine?
4-[3-[6-(3,6-dihydro-2H-pyran-4-yl)-3-pyridinyl]-2-methylimidazo[1,2-b]pyridazin-8-yl]morpholine has a molecular weight of 377.45 g/mol, XLogP of 2.74, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-[6-(3,6-dihydro-2H-pyran-4-yl)-3-pyridinyl]-2-methylimidazo[1,2-b]pyridazin-8-yl]morpholine is sourced from PubChem (CID 58496276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).