4-[[4-[(2-cyclopropylimidazo[1,2-b]pyridazin-6-yl)oxymethyl]piperidin-1-yl]methyl]-1,3-oxazole

C19H23N5O2 — CID 154575386

IUPAC4-[[4-[(2-cyclopropylimidazo[1,2-b]pyridazin-6-yl)oxymethyl]piperidin-1-yl]methyl]-1,3-oxazole
SMILESc1nc(CN2CCC(COc3ccc4nc(C5CC5)cn4n3)CC2)co1
InChIInChI=1S/C19H23N5O2/c1-2-15(1)17-10-24-18(21-17)3-4-19(22-24)26-11-14-5-7-23(8-6-14)9-16-12-25-13-20-16/h3-4,10,12-15H,1-2,5-9,11H2
InChIKeyXJLSQQXASFPBOJ-UHFFFAOYSA-N
MW353.43 g/mol
LogP2.89
Rot. Bonds6

About 4-[[4-[(2-cyclopropylimidazo[1,2-b]pyridazin-6-yl)oxymethyl]piperidin-1-yl]methyl]-1,3-oxazole

4-[[4-[(2-cyclopropylimidazo[1,2-b]pyridazin-6-yl)oxymethyl]piperidin-1-yl]methyl]-1,3-oxazole (PubChem CID 154575386) has the molecular formula C19H23N5O2 and a molecular weight of 353.43 g/mol. Its IUPAC name is 4-[[4-[(2-cyclopropylimidazo[1,2-b]pyridazin-6-yl)oxymethyl]piperidin-1-yl]methyl]-1,3-oxazole.

Molecular Properties

Compound Name4-[[4-[(2-cyclopropylimidazo[1,2-b]pyridazin-6-yl)oxymethyl]piperidin-1-yl]methyl]-1,3-oxazole
PubChem CID154575386
Molecular FormulaC19H23N5O2
Molecular Weight353.43 g/mol
Exact Mass353.19
IUPAC Name4-[[4-[(2-cyclopropylimidazo[1,2-b]pyridazin-6-yl)oxymethyl]piperidin-1-yl]methyl]-1,3-oxazole
SMILESc1nc(CN2CCC(COc3ccc4nc(C5CC5)cn4n3)CC2)co1
InChIInChI=1S/C19H23N5O2/c1-2-15(1)17-10-24-18(21-17)3-4-19(22-24)26-11-14-5-7-23(8-6-14)9-16-12-25-13-20-16/h3-4,10,12-15H,1-2,5-9,11H2
InChIKeyXJLSQQXASFPBOJ-UHFFFAOYSA-N
XLogP2.89
TPSA68.69 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.43
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 4-[[4-[(2-cyclopropylimidazo[1,2-b]pyridazin-6-yl)oxymethyl]piperidin-1-yl]methyl]-1,3-oxazole with MolForge

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Related Compounds

[4-[(2-cyclopropylimidazo[1,2-b]pyridazin-6-yl)oxymethyl]piperidin-1-yl]-pyridin-2-ylmethanone
CID 154576392
4-[[4-(6-methoxy-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)piperidin-1-yl]methyl]-1,3-oxazole
CID 126911668
[1-(1,3-oxazol-4-ylmethyl)piperidin-4-yl]methanamine;hydrochloride
CID 130694081
N-methyl-1-[1-(1,3-oxazol-4-ylmethyl)piperidin-4-yl]methanamine;hydrochloride
CID 120838868
9-methyl-6-[4-[(2-methylimidazo[1,2-b]pyridazin-6-yl)oxymethyl]piperidin-1-yl]purine
CID 154580530
4-[[3-(2-methylpropyl)pyrrolidin-1-yl]methyl]-1,3-oxazole
CID 169242095
(2,5-dimethylfuran-3-yl)-[4-[(2-methylimidazo[1,2-b]pyridazin-6-yl)oxymethyl]piperidin-1-yl]methanone
CID 154581448
2-methyl-6-[[1-(1-methylpyrazol-4-yl)sulfonylpiperidin-4-yl]methoxy]imidazo[1,2-b]pyridazine
CID 154581542
4-[[4-[4-(cyclopropylmethoxy)quinazolin-6-yl]piperazin-1-yl]methyl]-1,3-oxazole
CID 126896363
2-methyl-4-[[4-(pyridin-2-yloxymethyl)piperidin-1-yl]methyl]-1,3-oxazole
CID 126874266
(3,3-difluorocyclobutyl)-[4-[(2-methylimidazo[1,2-b]pyridazin-6-yl)oxymethyl]piperidin-1-yl]methanone
CID 163358243
[4-[(2-tert-butylimidazo[1,2-b]pyridazin-6-yl)oxymethyl]piperidin-1-yl]-pyridin-4-ylmethanone
CID 154576280

Frequently Asked Questions

What is the IUPAC name of 4-[[4-[(2-cyclopropylimidazo[1,2-b]pyridazin-6-yl)oxymethyl]piperidin-1-yl]methyl]-1,3-oxazole?
The IUPAC name of 4-[[4-[(2-cyclopropylimidazo[1,2-b]pyridazin-6-yl)oxymethyl]piperidin-1-yl]methyl]-1,3-oxazole (CID 154575386) is 4-[[4-[(2-cyclopropylimidazo[1,2-b]pyridazin-6-yl)oxymethyl]piperidin-1-yl]methyl]-1,3-oxazole.
What is the SMILES notation for 4-[[4-[(2-cyclopropylimidazo[1,2-b]pyridazin-6-yl)oxymethyl]piperidin-1-yl]methyl]-1,3-oxazole?
The canonical SMILES for 4-[[4-[(2-cyclopropylimidazo[1,2-b]pyridazin-6-yl)oxymethyl]piperidin-1-yl]methyl]-1,3-oxazole is c1nc(CN2CCC(COc3ccc4nc(C5CC5)cn4n3)CC2)co1.
What is the InChIKey of 4-[[4-[(2-cyclopropylimidazo[1,2-b]pyridazin-6-yl)oxymethyl]piperidin-1-yl]methyl]-1,3-oxazole?
The InChIKey is XJLSQQXASFPBOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O2/c1-2-15(1)17-10-24-18(21-17)3-4-19(22-24)26-11-14-5-7-23(8-6-14)9-16-12-25-13-20-16/h3-4,10,12-15H,1-2,5-9,11H2.
What are the key properties of 4-[[4-[(2-cyclopropylimidazo[1,2-b]pyridazin-6-yl)oxymethyl]piperidin-1-yl]methyl]-1,3-oxazole?
4-[[4-[(2-cyclopropylimidazo[1,2-b]pyridazin-6-yl)oxymethyl]piperidin-1-yl]methyl]-1,3-oxazole has a molecular weight of 353.43 g/mol, XLogP of 2.89, 6 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[4-[(2-cyclopropylimidazo[1,2-b]pyridazin-6-yl)oxymethyl]piperidin-1-yl]methyl]-1,3-oxazole is sourced from PubChem (CID 154575386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).