4-[2-(3-iodoimidazo[1,2-b]pyridazin-7-yl)oxyethyl]morpholine

C12H15IN4O2 — CID 155367109

IUPAC4-[2-(3-iodoimidazo[1,2-b]pyridazin-7-yl)oxyethyl]morpholine
SMILESIc1cnc2cc(OCCN3CCOCC3)cnn12
InChIInChI=1S/C12H15IN4O2/c13-11-9-14-12-7-10(8-15-17(11)12)19-6-3-16-1-4-18-5-2-16/h7-9H,1-6H2
InChIKeyIASQTHSYMCXQFQ-UHFFFAOYSA-N
MW374.18 g/mol
LogP1.04
Rot. Bonds4

About 4-[2-(3-iodoimidazo[1,2-b]pyridazin-7-yl)oxyethyl]morpholine

4-[2-(3-iodoimidazo[1,2-b]pyridazin-7-yl)oxyethyl]morpholine (PubChem CID 155367109) has the molecular formula C12H15IN4O2 and a molecular weight of 374.18 g/mol. Its IUPAC name is 4-[2-(3-iodoimidazo[1,2-b]pyridazin-7-yl)oxyethyl]morpholine.

Molecular Properties

Compound Name4-[2-(3-iodoimidazo[1,2-b]pyridazin-7-yl)oxyethyl]morpholine
PubChem CID155367109
Molecular FormulaC12H15IN4O2
Molecular Weight374.18 g/mol
Exact Mass374.02
IUPAC Name4-[2-(3-iodoimidazo[1,2-b]pyridazin-7-yl)oxyethyl]morpholine
SMILESIc1cnc2cc(OCCN3CCOCC3)cnn12
InChIInChI=1S/C12H15IN4O2/c13-11-9-14-12-7-10(8-15-17(11)12)19-6-3-16-1-4-18-5-2-16/h7-9H,1-6H2
InChIKeyIASQTHSYMCXQFQ-UHFFFAOYSA-N
XLogP1.04
TPSA51.89 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.18
LogP ≤ 51.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

4-(2-imidazo[1,2-b]pyridazin-7-yloxyethyl)morpholine;4-[2-(3-iodoimidazo[1,2-b]pyridazin-7-yl)oxyethyl]morpholine
CID 167644829
4-[2-(1-propan-2-ylpyrazol-4-yl)oxyethyl]morpholine
CID 116805370
4-[2-(4-ethynylphenoxy)ethyl]morpholine
CID 58608139
4-(2-morpholin-4-ylethoxy)aniline;hydrochloride
CID 89422137
methane;4-[2-(4-methylphenoxy)ethyl]morpholine
CID 162149342
1-(6-tert-butyl-1-oxa-2-azacyclohex-2-en-4-yn-3-yl)-3-[4-[2-[7-(2-morpholin-4-ylethoxy)imidazo[1,2-b]pyridazin-3-yl]ethynyl]phenyl]urea
CID 139418024
7-fluoroimidazo[1,2-a]pyridine;4-(2-imidazo[1,2-a]pyridin-7-yloxyethyl)morpholine
CID 167565148
4-[2-(3-methylpyrazolo[1,5-a]pyridin-6-yl)oxyethyl]morpholine
CID 155727791
4-[3-(3-iodophenoxy)propyl]morpholine
CID 47520354
ethane;4-[2-(3-methylphenoxy)ethyl]morpholine
CID 143019407
4-[2-(3-butoxyphenoxy)ethyl]morpholine
CID 2993436
4-[2-(2,3-dihydro-1H-isoindol-5-yloxy)ethyl]morpholine
CID 66657088

Frequently Asked Questions

What is the IUPAC name of 4-[2-(3-iodoimidazo[1,2-b]pyridazin-7-yl)oxyethyl]morpholine?
The IUPAC name of 4-[2-(3-iodoimidazo[1,2-b]pyridazin-7-yl)oxyethyl]morpholine (CID 155367109) is 4-[2-(3-iodoimidazo[1,2-b]pyridazin-7-yl)oxyethyl]morpholine.
What is the SMILES notation for 4-[2-(3-iodoimidazo[1,2-b]pyridazin-7-yl)oxyethyl]morpholine?
The canonical SMILES for 4-[2-(3-iodoimidazo[1,2-b]pyridazin-7-yl)oxyethyl]morpholine is Ic1cnc2cc(OCCN3CCOCC3)cnn12.
What is the InChIKey of 4-[2-(3-iodoimidazo[1,2-b]pyridazin-7-yl)oxyethyl]morpholine?
The InChIKey is IASQTHSYMCXQFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15IN4O2/c13-11-9-14-12-7-10(8-15-17(11)12)19-6-3-16-1-4-18-5-2-16/h7-9H,1-6H2.
What are the key properties of 4-[2-(3-iodoimidazo[1,2-b]pyridazin-7-yl)oxyethyl]morpholine?
4-[2-(3-iodoimidazo[1,2-b]pyridazin-7-yl)oxyethyl]morpholine has a molecular weight of 374.18 g/mol, XLogP of 1.04, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(3-iodoimidazo[1,2-b]pyridazin-7-yl)oxyethyl]morpholine is sourced from PubChem (CID 155367109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).