(6-chloro-2-ethenylimidazo[1,2-b]pyridazin-3-yl)methanol

C9H8ClN3O — CID 145157581

IUPAC(6-chloro-2-ethenylimidazo[1,2-b]pyridazin-3-yl)methanol
SMILESC=Cc1nc2ccc(Cl)nn2c1CO
InChIInChI=1S/C9H8ClN3O/c1-2-6-7(5-14)13-9(11-6)4-3-8(10)12-13/h2-4,14H,1,5H2
InChIKeySNHPDQCDDFBSOO-UHFFFAOYSA-N
MW209.64 g/mol
LogP1.52
Rot. Bonds2

About (6-chloro-2-ethenylimidazo[1,2-b]pyridazin-3-yl)methanol

(6-chloro-2-ethenylimidazo[1,2-b]pyridazin-3-yl)methanol (PubChem CID 145157581) has the molecular formula C9H8ClN3O and a molecular weight of 209.64 g/mol. Its IUPAC name is (6-chloro-2-ethenylimidazo[1,2-b]pyridazin-3-yl)methanol.

Molecular Properties

Compound Name(6-chloro-2-ethenylimidazo[1,2-b]pyridazin-3-yl)methanol
PubChem CID145157581
Molecular FormulaC9H8ClN3O
Molecular Weight209.64 g/mol
Exact Mass209.04
IUPAC Name(6-chloro-2-ethenylimidazo[1,2-b]pyridazin-3-yl)methanol
SMILESC=Cc1nc2ccc(Cl)nn2c1CO
InChIInChI=1S/C9H8ClN3O/c1-2-6-7(5-14)13-9(11-6)4-3-8(10)12-13/h2-4,14H,1,5H2
InChIKeySNHPDQCDDFBSOO-UHFFFAOYSA-N
XLogP1.52
TPSA50.42 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.64
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(6-Chloroimidazo[1,2-b]pyridazin-2-yl)methanol
CID 42609596
(6-Chloroimidazo(1,2-b)pyridazin-3-yl)methanol
CID 57352521
(6-Chloro-2-cyclopropylimidazo[1,2-b]pyridazin-3-yl)methanol
CID 58009731
2-(6-Chloroimidazo[1,2-b]pyridazin-2-yl)propan-2-ol
CID 58216650
(6-Chloro-2-methyl-imidazo[1,2-b]pyridazin-3-yl)-methanol
CID 85955264
6-Chloro-2-cyclobutyl-imidazo[1,2-b]pyridazine-3-methanol
CID 87771582
[6-Chloro-2-(cyclobutadienyl)imidazo[1,2-b]pyridazin-3-yl]methanol
CID 87771583
(6-Chloroimidazo[1,2-b]pyridazin-3-yl)-(4-methylpiperazin-1-yl)methanol
CID 89216441
6-Chloro-3-ethylimidazo[1,2-b]pyridazin-2-ol
CID 89515594
(6-Chloro-3-methylimidazo[1,2-b]pyridazin-2-yl)methanol
CID 90135427
(6-Iodo-3-methylimidazo[1,2-b]pyridazin-2-yl)methanol
CID 118278231
1-(7-Chloroimidazo[1,2-b]pyridazin-3-yl)ethanol
CID 122622072

Frequently Asked Questions

What is the IUPAC name of (6-chloro-2-ethenylimidazo[1,2-b]pyridazin-3-yl)methanol?
The IUPAC name of (6-chloro-2-ethenylimidazo[1,2-b]pyridazin-3-yl)methanol (CID 145157581) is (6-chloro-2-ethenylimidazo[1,2-b]pyridazin-3-yl)methanol.
What is the SMILES notation for (6-chloro-2-ethenylimidazo[1,2-b]pyridazin-3-yl)methanol?
The canonical SMILES for (6-chloro-2-ethenylimidazo[1,2-b]pyridazin-3-yl)methanol is C=Cc1nc2ccc(Cl)nn2c1CO.
What is the InChIKey of (6-chloro-2-ethenylimidazo[1,2-b]pyridazin-3-yl)methanol?
The InChIKey is SNHPDQCDDFBSOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8ClN3O/c1-2-6-7(5-14)13-9(11-6)4-3-8(10)12-13/h2-4,14H,1,5H2.
What are the key properties of (6-chloro-2-ethenylimidazo[1,2-b]pyridazin-3-yl)methanol?
(6-chloro-2-ethenylimidazo[1,2-b]pyridazin-3-yl)methanol has a molecular weight of 209.64 g/mol, XLogP of 1.52, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6-chloro-2-ethenylimidazo[1,2-b]pyridazin-3-yl)methanol is sourced from PubChem (CID 145157581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).