6-chloro-8-(4,4-difluorocyclohexyl)imidazo[1,2-b]pyridazine

C12H12ClF2N3 — CID 157034181

IUPAC6-chloro-8-(4,4-difluorocyclohexyl)imidazo[1,2-b]pyridazine
SMILESFC1(F)CCC(c2cc(Cl)nn3ccnc23)CC1
InChIInChI=1S/C12H12ClF2N3/c13-10-7-9(11-16-5-6-18(11)17-10)8-1-3-12(14,15)4-2-8/h5-8H,1-4H2
InChIKeyJDUQYCUVMUSVER-UHFFFAOYSA-N
MW271.70 g/mol
LogP3.68
Rot. Bonds1

About 6-chloro-8-(4,4-difluorocyclohexyl)imidazo[1,2-b]pyridazine

6-chloro-8-(4,4-difluorocyclohexyl)imidazo[1,2-b]pyridazine (PubChem CID 157034181) has the molecular formula C12H12ClF2N3 and a molecular weight of 271.70 g/mol. Its IUPAC name is 6-chloro-8-(4,4-difluorocyclohexyl)imidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name6-chloro-8-(4,4-difluorocyclohexyl)imidazo[1,2-b]pyridazine
PubChem CID157034181
Molecular FormulaC12H12ClF2N3
Molecular Weight271.70 g/mol
Exact Mass271.07
IUPAC Name6-chloro-8-(4,4-difluorocyclohexyl)imidazo[1,2-b]pyridazine
SMILESFC1(F)CCC(c2cc(Cl)nn3ccnc23)CC1
InChIInChI=1S/C12H12ClF2N3/c13-10-7-9(11-16-5-6-18(11)17-10)8-1-3-12(14,15)4-2-8/h5-8H,1-4H2
InChIKeyJDUQYCUVMUSVER-UHFFFAOYSA-N
XLogP3.68
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.70
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

6-chloro-8-cyclopropylimidazo[1,2-b]pyridazine;3-chloro-1-(2,2,2-trifluoroethyl)indazole
CID 157035100
6-chloro-8-[3-(2,2-difluorocyclopropyl)azetidin-1-yl]imidazo[1,2-b]pyridazine
CID 157033945
6-chloro-8-[(1S,2S)-2-(2,3,5-trifluorophenyl)cyclopropyl]imidazo[1,2-b]pyridazine
CID 157032424
6-chloro-8-[(3R,4S)-3,4-difluoropyrrolidin-1-yl]imidazo[1,2-b]pyridazine
CID 157033258
6-chloro-8-[(1R,2R)-2-[2-(trifluoromethyl)pyrimidin-5-yl]cyclopropyl]imidazo[1,2-b]pyridazine
CID 157033953
[1-(6-chloroimidazo[1,2-b]pyridazin-8-yl)-3-fluoroazetidin-3-yl]methanol
CID 157032463
6-chloro-8-pyrrolidin-1-ylimidazo[1,2-b]pyridazine
CID 157033680
6-chloro-8-[(1S,2S)-2-[1-(difluoromethyl)pyrazol-4-yl]cyclopropyl]imidazo[1,2-b]pyridazine
CID 157033097
8-[(4S)-2-azabicyclo[2.2.1]heptan-2-yl]-6-chloroimidazo[1,2-b]pyridazine
CID 157034233
5-[(1S,2S)-2-(6-chloroimidazo[1,2-b]pyridazin-8-yl)cyclopropyl]-2-fluorobenzonitrile
CID 157033187
6-chloro-8-[(1S,2S)-2-[4-(2,2-difluoroethoxy)phenyl]cyclopropyl]imidazo[1,2-b]pyridazine
CID 157033292
5'-[(1S,2S)-2-(6-chloroimidazo[1,2-b]pyridazin-8-yl)cyclopropyl]-4'-fluoro-1'-(2,2,2-trifluoroethyl)spiro[cyclopropane-1,3'-indole]-2'-one
CID 175843040

Frequently Asked Questions

What is the IUPAC name of 6-chloro-8-(4,4-difluorocyclohexyl)imidazo[1,2-b]pyridazine?
The IUPAC name of 6-chloro-8-(4,4-difluorocyclohexyl)imidazo[1,2-b]pyridazine (CID 157034181) is 6-chloro-8-(4,4-difluorocyclohexyl)imidazo[1,2-b]pyridazine.
What is the SMILES notation for 6-chloro-8-(4,4-difluorocyclohexyl)imidazo[1,2-b]pyridazine?
The canonical SMILES for 6-chloro-8-(4,4-difluorocyclohexyl)imidazo[1,2-b]pyridazine is FC1(F)CCC(c2cc(Cl)nn3ccnc23)CC1.
What is the InChIKey of 6-chloro-8-(4,4-difluorocyclohexyl)imidazo[1,2-b]pyridazine?
The InChIKey is JDUQYCUVMUSVER-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12ClF2N3/c13-10-7-9(11-16-5-6-18(11)17-10)8-1-3-12(14,15)4-2-8/h5-8H,1-4H2.
What are the key properties of 6-chloro-8-(4,4-difluorocyclohexyl)imidazo[1,2-b]pyridazine?
6-chloro-8-(4,4-difluorocyclohexyl)imidazo[1,2-b]pyridazine has a molecular weight of 271.70 g/mol, XLogP of 3.68, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-8-(4,4-difluorocyclohexyl)imidazo[1,2-b]pyridazine is sourced from PubChem (CID 157034181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).