3-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)imidazo[1,2-b]pyridazin-6-amine

C20H19N5O — CID 58857576

IUPAC3-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)imidazo[1,2-b]pyridazin-6-amine
SMILESCOc1cccc(-c2cnc3ccc(NCCc4ccccn4)nn23)c1
InChIInChI=1S/C20H19N5O/c1-26-17-7-4-5-15(13-17)18-14-23-20-9-8-19(24-25(18)20)22-12-10-16-6-2-3-11-21-16/h2-9,11,13-14H,10,12H2,1H3,(H,22,24)
InChIKeyORLBOJZDRUBCFC-UHFFFAOYSA-N
MW345.41 g/mol
LogP3.45
Rot. Bonds6

About 3-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)imidazo[1,2-b]pyridazin-6-amine

3-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)imidazo[1,2-b]pyridazin-6-amine (PubChem CID 58857576) has the molecular formula C20H19N5O and a molecular weight of 345.41 g/mol. Its IUPAC name is 3-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)imidazo[1,2-b]pyridazin-6-amine.

Molecular Properties

Compound Name3-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)imidazo[1,2-b]pyridazin-6-amine
PubChem CID58857576
Molecular FormulaC20H19N5O
Molecular Weight345.41 g/mol
Exact Mass345.16
IUPAC Name3-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)imidazo[1,2-b]pyridazin-6-amine
SMILESCOc1cccc(-c2cnc3ccc(NCCc4ccccn4)nn23)c1
InChIInChI=1S/C20H19N5O/c1-26-17-7-4-5-15(13-17)18-14-23-20-9-8-19(24-25(18)20)22-12-10-16-6-2-3-11-21-16/h2-9,11,13-14H,10,12H2,1H3,(H,22,24)
InChIKeyORLBOJZDRUBCFC-UHFFFAOYSA-N
XLogP3.45
TPSA64.34 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.41
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-(4-methylphenyl)-N-(pyridin-2-ylmethyl)imidazo[1,2-b]pyridazin-6-amine
CID 143711795
N-(2-pyridin-3-ylethyl)-3-(3,4,5-trimethoxyphenyl)imidazo[1,2-b]pyridazin-6-amine
CID 58857590
3-[6-(2-methoxyethylamino)imidazo[1,2-b]pyridazin-3-yl]benzoic acid
CID 126471896
3-(4-fluorophenyl)-N-(pyridin-2-ylmethyl)imidazo[1,2-b]pyridazin-6-amine
CID 58857801
3-(4-methoxyphenyl)-N-(pyridin-3-ylmethyl)imidazo[1,2-b]pyridazin-6-amine
CID 44580233
6-methoxy-N-(2-pyridin-2-ylethyl)pyridin-2-amine
CID 63591274
N-[3-(3,4-dimethoxyphenyl)imidazo[1,2-b]pyridazin-6-yl]-N',N'-dimethylethane-1,2-diamine
CID 24997044
N',N'-dimethyl-N-[3-(4-phenoxyphenyl)imidazo[1,2-b]pyridazin-6-yl]ethane-1,2-diamine
CID 69146622
5-(6-methoxy-3-pyridinyl)-N-(2-pyridin-2-ylethyl)imidazo[2,1-b][1,3,4]thiadiazol-2-amine
CID 67221072
1-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)ethanamine
CID 43193663
1-(2,4-dimethylphenyl)-3-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)pyrazole-5-carboxamide
CID 3348957
3-[[3-(2-methoxyphenyl)imidazo[1,2-b]pyridazin-6-yl]amino]propan-1-ol
CID 126470569

Frequently Asked Questions

What is the IUPAC name of 3-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)imidazo[1,2-b]pyridazin-6-amine?
The IUPAC name of 3-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)imidazo[1,2-b]pyridazin-6-amine (CID 58857576) is 3-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)imidazo[1,2-b]pyridazin-6-amine.
What is the SMILES notation for 3-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)imidazo[1,2-b]pyridazin-6-amine?
The canonical SMILES for 3-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)imidazo[1,2-b]pyridazin-6-amine is COc1cccc(-c2cnc3ccc(NCCc4ccccn4)nn23)c1.
What is the InChIKey of 3-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)imidazo[1,2-b]pyridazin-6-amine?
The InChIKey is ORLBOJZDRUBCFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N5O/c1-26-17-7-4-5-15(13-17)18-14-23-20-9-8-19(24-25(18)20)22-12-10-16-6-2-3-11-21-16/h2-9,11,13-14H,10,12H2,1H3,(H,22,24).
What are the key properties of 3-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)imidazo[1,2-b]pyridazin-6-amine?
3-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)imidazo[1,2-b]pyridazin-6-amine has a molecular weight of 345.41 g/mol, XLogP of 3.45, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)imidazo[1,2-b]pyridazin-6-amine is sourced from PubChem (CID 58857576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).