(2-cyclopropyl-6-iodoimidazo[1,2-b]pyridazin-3-yl)methanol

C10H10IN3O — CID 118278244

IUPAC(2-cyclopropyl-6-iodoimidazo[1,2-b]pyridazin-3-yl)methanol
SMILESOCc1c(C2CC2)nc2ccc(I)nn12
InChIInChI=1S/C10H10IN3O/c11-8-3-4-9-12-10(6-1-2-6)7(5-15)14(9)13-8/h3-4,6,15H,1-2,5H2
InChIKeyABDWCXOAGGMUAH-UHFFFAOYSA-N
MW315.11 g/mol
LogP1.70
Rot. Bonds2

About (2-cyclopropyl-6-iodoimidazo[1,2-b]pyridazin-3-yl)methanol

(2-cyclopropyl-6-iodoimidazo[1,2-b]pyridazin-3-yl)methanol (PubChem CID 118278244) has the molecular formula C10H10IN3O and a molecular weight of 315.11 g/mol. Its IUPAC name is (2-cyclopropyl-6-iodoimidazo[1,2-b]pyridazin-3-yl)methanol.

Molecular Properties

Compound Name(2-cyclopropyl-6-iodoimidazo[1,2-b]pyridazin-3-yl)methanol
PubChem CID118278244
Molecular FormulaC10H10IN3O
Molecular Weight315.11 g/mol
Exact Mass314.99
IUPAC Name(2-cyclopropyl-6-iodoimidazo[1,2-b]pyridazin-3-yl)methanol
SMILESOCc1c(C2CC2)nc2ccc(I)nn12
InChIInChI=1S/C10H10IN3O/c11-8-3-4-9-12-10(6-1-2-6)7(5-15)14(9)13-8/h3-4,6,15H,1-2,5H2
InChIKeyABDWCXOAGGMUAH-UHFFFAOYSA-N
XLogP1.70
TPSA50.42 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.11
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-Ethyl-6,8-dimethyl-3-hydroxymethylimidazo[1,2-b]pyridazine
CID 19784143
(6-Chloro-2-cyclopropylimidazo[1,2-b]pyridazin-3-yl)methanol
CID 58009731
6-Chloro-2-cyclobutyl-imidazo[1,2-b]pyridazine-3-methanol
CID 87771582
(2,3-Dimethylimidazo[1,2-b]pyridazin-6-yl)methanol
CID 118278123
2-Cyclopropyl-6-iodo-3-methylimidazo[1,2-b]pyridazine
CID 118278171
(6-Iodo-3-methylimidazo[1,2-b]pyridazin-2-yl)methanol
CID 118278231
(2-Cyclopropyl-6-ethylimidazo[1,2-b]pyridazin-3-yl)methanol
CID 123975162
(2-Cyclopropyl-6-methylimidazo[1,2-b]pyridazin-3-yl)methanol
CID 139439245
(2-Cyclopropyl-6-methylimidazo[1,2-b]pyridazin-3-yl)methanol;ethane
CID 144895128

Frequently Asked Questions

What is the IUPAC name of (2-cyclopropyl-6-iodoimidazo[1,2-b]pyridazin-3-yl)methanol?
The IUPAC name of (2-cyclopropyl-6-iodoimidazo[1,2-b]pyridazin-3-yl)methanol (CID 118278244) is (2-cyclopropyl-6-iodoimidazo[1,2-b]pyridazin-3-yl)methanol.
What is the SMILES notation for (2-cyclopropyl-6-iodoimidazo[1,2-b]pyridazin-3-yl)methanol?
The canonical SMILES for (2-cyclopropyl-6-iodoimidazo[1,2-b]pyridazin-3-yl)methanol is OCc1c(C2CC2)nc2ccc(I)nn12.
What is the InChIKey of (2-cyclopropyl-6-iodoimidazo[1,2-b]pyridazin-3-yl)methanol?
The InChIKey is ABDWCXOAGGMUAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10IN3O/c11-8-3-4-9-12-10(6-1-2-6)7(5-15)14(9)13-8/h3-4,6,15H,1-2,5H2.
What are the key properties of (2-cyclopropyl-6-iodoimidazo[1,2-b]pyridazin-3-yl)methanol?
(2-cyclopropyl-6-iodoimidazo[1,2-b]pyridazin-3-yl)methanol has a molecular weight of 315.11 g/mol, XLogP of 1.70, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclopropyl-6-iodoimidazo[1,2-b]pyridazin-3-yl)methanol is sourced from PubChem (CID 118278244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).