imidazo[1,2-b]pyridazin-3-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone

C15H18N4O — CID 171945561

IUPACimidazo[1,2-b]pyridazin-3-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone
SMILESCN1C2CCC1CC(C(=O)c1cnc3cccnn13)C2
InChIInChI=1S/C15H18N4O/c1-18-11-4-5-12(18)8-10(7-11)15(20)13-9-16-14-3-2-6-17-19(13)14/h2-3,6,9-12H,4-5,7-8H2,1H3
InChIKeyNQYQUXZZVMNJND-UHFFFAOYSA-N
MW270.34 g/mol
LogP1.78
Rot. Bonds2

About imidazo[1,2-b]pyridazin-3-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone

imidazo[1,2-b]pyridazin-3-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone (PubChem CID 171945561) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is imidazo[1,2-b]pyridazin-3-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone.

Molecular Properties

Compound Nameimidazo[1,2-b]pyridazin-3-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone
PubChem CID171945561
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC Nameimidazo[1,2-b]pyridazin-3-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone
SMILESCN1C2CCC1CC(C(=O)c1cnc3cccnn13)C2
InChIInChI=1S/C15H18N4O/c1-18-11-4-5-12(18)8-10(7-11)15(20)13-9-16-14-3-2-6-17-19(13)14/h2-3,6,9-12H,4-5,7-8H2,1H3
InChIKeyNQYQUXZZVMNJND-UHFFFAOYSA-N
XLogP1.78
TPSA50.50 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 51.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze imidazo[1,2-b]pyridazin-3-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[6-[(2R)-2-(5-fluorocyclohexa-2,4-dien-1-yl)pyrrolidin-1-yl]imidazo[1,2-b]pyridazin-3-yl]ethanone
CID 144344739
3-(3-fluorocyclohexa-2,4-dien-1-yl)-1-[6-[(2R)-2-(3-fluorophenyl)pyrrolidin-1-yl]imidazo[1,2-b]pyridazin-3-yl]propan-1-one
CID 144344753
1-Imidazo[1,2-b]pyridazin-2-yl-2-methylpropan-1-one
CID 59326840
1-Imidazo[1,2-b]pyridazin-3-yl-2-methylpropan-1-one
CID 69097594
1-[6-(4-Propan-2-ylpiperazin-1-yl)imidazo[1,2-b]pyridazin-3-yl]ethanone
CID 89802322
1-[6-(4-Methylpiperazin-1-yl)imidazo[1,2-b]pyridazin-3-yl]-2-pyridin-3-ylethanone
CID 135201832
1-[6-[4-(1-Aminocyclopentanecarbonyl)piperazin-1-yl]imidazo[1,2-b]pyridazin-3-yl]ethanone
CID 141633561
1-Imidazo[1,2-b]pyridazin-3-ylpropan-1-one
CID 159844410
1-Imidazo[1,2-b]pyridazin-3-yl-2,2-dimethylpropan-1-one
CID 171409936
[(2R,4S)-2,4-dicyclopropylpyrrolidin-1-yl]-imidazo[1,2-b]pyridazin-3-ylmethanone
CID 136586862
3-{[rel-(1S,2S,4R)-2-ethyl-2-(1-piperidinylcarbonyl)-7-azabicyclo[2.2.1]hept-7-yl]carbonyl}imidazo[1,2-b]pyridazine formate
CID 154815779
1-(Imidazo[1,2-b]pyridazin-3-ylcarbonyl)-7-isopropyl-1,7-diazaspiro[4.5]decan-6-one
CID 163305304

Frequently Asked Questions

What is the IUPAC name of imidazo[1,2-b]pyridazin-3-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone?
The IUPAC name of imidazo[1,2-b]pyridazin-3-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone (CID 171945561) is imidazo[1,2-b]pyridazin-3-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone.
What is the SMILES notation for imidazo[1,2-b]pyridazin-3-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone?
The canonical SMILES for imidazo[1,2-b]pyridazin-3-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone is CN1C2CCC1CC(C(=O)c1cnc3cccnn13)C2.
What is the InChIKey of imidazo[1,2-b]pyridazin-3-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone?
The InChIKey is NQYQUXZZVMNJND-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c1-18-11-4-5-12(18)8-10(7-11)15(20)13-9-16-14-3-2-6-17-19(13)14/h2-3,6,9-12H,4-5,7-8H2,1H3.
What are the key properties of imidazo[1,2-b]pyridazin-3-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone?
imidazo[1,2-b]pyridazin-3-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone has a molecular weight of 270.34 g/mol, XLogP of 1.78, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for imidazo[1,2-b]pyridazin-3-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone is sourced from PubChem (CID 171945561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).