N-(3-morpholin-4-ylpropyl)-3-pent-1-enylimidazo[1,2-b]pyridazin-6-amine

C18H27N5O — CID 68648132

IUPACN-(3-morpholin-4-ylpropyl)-3-pent-1-enylimidazo[1,2-b]pyridazin-6-amine
SMILESCCCC=Cc1cnc2ccc(NCCCN3CCOCC3)nn12
InChIInChI=1S/C18H27N5O/c1-2-3-4-6-16-15-20-18-8-7-17(21-23(16)18)19-9-5-10-22-11-13-24-14-12-22/h4,6-8,15H,2-3,5,9-14H2,1H3,(H,19,21)
InChIKeyLDSXDFWNBJPVLM-UHFFFAOYSA-N
MW329.45 g/mol
LogP2.68
Rot. Bonds8

About N-(3-morpholin-4-ylpropyl)-3-pent-1-enylimidazo[1,2-b]pyridazin-6-amine

N-(3-morpholin-4-ylpropyl)-3-pent-1-enylimidazo[1,2-b]pyridazin-6-amine (PubChem CID 68648132) has the molecular formula C18H27N5O and a molecular weight of 329.45 g/mol. Its IUPAC name is N-(3-morpholin-4-ylpropyl)-3-pent-1-enylimidazo[1,2-b]pyridazin-6-amine.

Molecular Properties

Compound NameN-(3-morpholin-4-ylpropyl)-3-pent-1-enylimidazo[1,2-b]pyridazin-6-amine
PubChem CID68648132
Molecular FormulaC18H27N5O
Molecular Weight329.45 g/mol
Exact Mass329.22
IUPAC NameN-(3-morpholin-4-ylpropyl)-3-pent-1-enylimidazo[1,2-b]pyridazin-6-amine
SMILESCCCC=Cc1cnc2ccc(NCCCN3CCOCC3)nn12
InChIInChI=1S/C18H27N5O/c1-2-3-4-6-16-15-20-18-8-7-17(21-23(16)18)19-9-5-10-22-11-13-24-14-12-22/h4,6-8,15H,2-3,5,9-14H2,1H3,(H,19,21)
InChIKeyLDSXDFWNBJPVLM-UHFFFAOYSA-N
XLogP2.68
TPSA54.69 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.45
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

Sdccggsk-0000064.P001
CID 44589696
3-[6-(2-methoxyethylamino)-3-pyridyl]-N-(1-methyl-4-piperidyl)imidazo[1,2-b]pyridazin-6-amine
CID 53357956
(2S)-2-[[3-(2-aminopyrimidin-4-yl)imidazo[1,2-b]pyridazin-6-yl]amino]butan-1-ol
CID 137645650
(E)-2-(3-(Hex-1-enyl)imidazo[1,2-b]pyridazin-6-ylamino)butan-1-ol
CID 59519594
4-Pyrrolo[2,1-f][1,2,4]triazin-4-ylmorpholine
CID 118711765
3-N-(3-fluoro-5-morpholin-4-ylphenyl)-6-N,6-N-dimethylimidazo[1,2-b]pyridazine-3,6-diamine
CID 134808742
2-N-(2-morpholin-4-ylethyl)-8-N-(pyridin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridine-2,8-diamine
CID 59612331
5-methyl-N-(3-morpholin-4-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine;hydrochloride
CID 12366069
N-(1,4-dioxan-2-ylmethyl)-6-(1-methyl-1H-imidazol-2-yl)pyridazin-3-amine
CID 56755879
N-[[4-[(1-ethylimidazol-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine
CID 71872273
N-ethyl-N-[[4-(1H-imidazol-2-ylmethyl)morpholin-2-yl]methyl]pyridazin-3-amine
CID 71872607
6-methyl-N-(2-morpholin-4-ylethyl)-[1,2,4]triazolo[4,3-b]pyridazin-8-amine
CID 90671738

Frequently Asked Questions

What is the IUPAC name of N-(3-morpholin-4-ylpropyl)-3-pent-1-enylimidazo[1,2-b]pyridazin-6-amine?
The IUPAC name of N-(3-morpholin-4-ylpropyl)-3-pent-1-enylimidazo[1,2-b]pyridazin-6-amine (CID 68648132) is N-(3-morpholin-4-ylpropyl)-3-pent-1-enylimidazo[1,2-b]pyridazin-6-amine.
What is the SMILES notation for N-(3-morpholin-4-ylpropyl)-3-pent-1-enylimidazo[1,2-b]pyridazin-6-amine?
The canonical SMILES for N-(3-morpholin-4-ylpropyl)-3-pent-1-enylimidazo[1,2-b]pyridazin-6-amine is CCCC=Cc1cnc2ccc(NCCCN3CCOCC3)nn12.
What is the InChIKey of N-(3-morpholin-4-ylpropyl)-3-pent-1-enylimidazo[1,2-b]pyridazin-6-amine?
The InChIKey is LDSXDFWNBJPVLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N5O/c1-2-3-4-6-16-15-20-18-8-7-17(21-23(16)18)19-9-5-10-22-11-13-24-14-12-22/h4,6-8,15H,2-3,5,9-14H2,1H3,(H,19,21).
What are the key properties of N-(3-morpholin-4-ylpropyl)-3-pent-1-enylimidazo[1,2-b]pyridazin-6-amine?
N-(3-morpholin-4-ylpropyl)-3-pent-1-enylimidazo[1,2-b]pyridazin-6-amine has a molecular weight of 329.45 g/mol, XLogP of 2.68, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-morpholin-4-ylpropyl)-3-pent-1-enylimidazo[1,2-b]pyridazin-6-amine is sourced from PubChem (CID 68648132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).