6-morpholin-4-yl-2-phenylimidazo[1,2-b]pyridazine-3-carboxylic acid

C17H16N4O3 — CID 156641443

IUPAC6-morpholin-4-yl-2-phenylimidazo[1,2-b]pyridazine-3-carboxylic acid
SMILESO=C(O)c1c(-c2ccccc2)nc2ccc(N3CCOCC3)nn12
InChIInChI=1S/C17H16N4O3/c22-17(23)16-15(12-4-2-1-3-5-12)18-13-6-7-14(19-21(13)16)20-8-10-24-11-9-20/h1-7H,8-11H2,(H,22,23)
InChIKeySZNVZICYHHMLSU-UHFFFAOYSA-N
MW324.34 g/mol
LogP1.93
Rot. Bonds3

About 6-morpholin-4-yl-2-phenylimidazo[1,2-b]pyridazine-3-carboxylic acid

6-morpholin-4-yl-2-phenylimidazo[1,2-b]pyridazine-3-carboxylic acid (PubChem CID 156641443) has the molecular formula C17H16N4O3 and a molecular weight of 324.34 g/mol. Its IUPAC name is 6-morpholin-4-yl-2-phenylimidazo[1,2-b]pyridazine-3-carboxylic acid.

Molecular Properties

Compound Name6-morpholin-4-yl-2-phenylimidazo[1,2-b]pyridazine-3-carboxylic acid
PubChem CID156641443
Molecular FormulaC17H16N4O3
Molecular Weight324.34 g/mol
Exact Mass324.12
IUPAC Name6-morpholin-4-yl-2-phenylimidazo[1,2-b]pyridazine-3-carboxylic acid
SMILESO=C(O)c1c(-c2ccccc2)nc2ccc(N3CCOCC3)nn12
InChIInChI=1S/C17H16N4O3/c22-17(23)16-15(12-4-2-1-3-5-12)18-13-6-7-14(19-21(13)16)20-8-10-24-11-9-20/h1-7H,8-11H2,(H,22,23)
InChIKeySZNVZICYHHMLSU-UHFFFAOYSA-N
XLogP1.93
TPSA79.96 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.34
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-phenyl-6-pyrrolidin-1-ylimidazo[1,2-b]pyridazine-3-carboxamide
CID 69380502
N-tert-butyl-6-morpholin-4-yl-2-phenylimidazo[1,2-b]pyridazin-3-amine
CID 135018214
N-[(2-phenyl-6-pyrrolidin-1-ylimidazo[1,2-b]pyridazin-3-yl)methyl]acetamide
CID 24753418
6-morpholin-4-yl-[1,2,4]triazolo[4,3-b]pyridazine-3-carboxamide
CID 12606975
4-(5-nitro-6-phenyl-2-pyridinyl)morpholine
CID 133407232
3-amino-2-methyl-7-morpholin-4-ylpyrimido[1,2-b]pyridazin-4-one
CID 82090462
2-morpholin-4-yl-6-[2-(trifluoromethyl)phenyl]imidazo[1,2-b]pyridazine-3-carboxylic acid
CID 151634107
1-[6-[(1S,4S)-5-methyl-2,5-diazabicyclo[2.2.1]heptan-2-yl]-2-phenylimidazo[1,2-b]pyridazin-3-yl]ethanone
CID 167622599
6-morpholin-4-yl-[1,2,4]triazolo[4,3-b]pyridazin-3-amine
CID 15107884
2-(6-ethoxy-2-phenylimidazo[1,2-b]pyridazin-3-yl)-1-morpholin-4-ylethanone
CID 66742848
6-(2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl)-2-phenyl-3-pyridin-4-ylimidazo[1,2-b]pyridazine
CID 68514785
(1,1-dioxo-6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-yl)-morpholin-4-ylmethanone
CID 50749892

Frequently Asked Questions

What is the IUPAC name of 6-morpholin-4-yl-2-phenylimidazo[1,2-b]pyridazine-3-carboxylic acid?
The IUPAC name of 6-morpholin-4-yl-2-phenylimidazo[1,2-b]pyridazine-3-carboxylic acid (CID 156641443) is 6-morpholin-4-yl-2-phenylimidazo[1,2-b]pyridazine-3-carboxylic acid.
What is the SMILES notation for 6-morpholin-4-yl-2-phenylimidazo[1,2-b]pyridazine-3-carboxylic acid?
The canonical SMILES for 6-morpholin-4-yl-2-phenylimidazo[1,2-b]pyridazine-3-carboxylic acid is O=C(O)c1c(-c2ccccc2)nc2ccc(N3CCOCC3)nn12.
What is the InChIKey of 6-morpholin-4-yl-2-phenylimidazo[1,2-b]pyridazine-3-carboxylic acid?
The InChIKey is SZNVZICYHHMLSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O3/c22-17(23)16-15(12-4-2-1-3-5-12)18-13-6-7-14(19-21(13)16)20-8-10-24-11-9-20/h1-7H,8-11H2,(H,22,23).
What are the key properties of 6-morpholin-4-yl-2-phenylimidazo[1,2-b]pyridazine-3-carboxylic acid?
6-morpholin-4-yl-2-phenylimidazo[1,2-b]pyridazine-3-carboxylic acid has a molecular weight of 324.34 g/mol, XLogP of 1.93, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-morpholin-4-yl-2-phenylimidazo[1,2-b]pyridazine-3-carboxylic acid is sourced from PubChem (CID 156641443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).