2-amino-2-(6-methoxyimidazo[1,2-b]pyridazin-3-yl)acetic acid

C9H10N4O3 — CID 83890426

IUPAC2-amino-2-(6-methoxyimidazo[1,2-b]pyridazin-3-yl)acetic acid
SMILESCOc1ccc2ncc(C(N)C(=O)O)n2n1
InChIInChI=1S/C9H10N4O3/c1-16-7-3-2-6-11-4-5(13(6)12-7)8(10)9(14)15/h2-4,8H,10H2,1H3,(H,14,15)
InChIKeyLJHDDIZBYHYBLK-UHFFFAOYSA-N
MW222.20 g/mol
LogP-0.18
Rot. Bonds3

About 2-amino-2-(6-methoxyimidazo[1,2-b]pyridazin-3-yl)acetic acid

2-amino-2-(6-methoxyimidazo[1,2-b]pyridazin-3-yl)acetic acid (PubChem CID 83890426) has the molecular formula C9H10N4O3 and a molecular weight of 222.20 g/mol. Its IUPAC name is 2-amino-2-(6-methoxyimidazo[1,2-b]pyridazin-3-yl)acetic acid.

Molecular Properties

Compound Name2-amino-2-(6-methoxyimidazo[1,2-b]pyridazin-3-yl)acetic acid
PubChem CID83890426
Molecular FormulaC9H10N4O3
Molecular Weight222.20 g/mol
Exact Mass222.08
IUPAC Name2-amino-2-(6-methoxyimidazo[1,2-b]pyridazin-3-yl)acetic acid
SMILESCOc1ccc2ncc(C(N)C(=O)O)n2n1
InChIInChI=1S/C9H10N4O3/c1-16-7-3-2-6-11-4-5(13(6)12-7)8(10)9(14)15/h2-4,8H,10H2,1H3,(H,14,15)
InChIKeyLJHDDIZBYHYBLK-UHFFFAOYSA-N
XLogP-0.18
TPSA102.74 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.20
LogP ≤ 5-0.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-amino-2-(6-methoxyimidazo[1,2-b]pyridazin-3-yl)ethanol
CID 83883676
3-(6-methoxyimidazo[1,2-b]pyridazin-3-yl)propanoic acid
CID 84686502
2-amino-2-(6-bromoimidazo[1,2-a]pyrazin-3-yl)acetic acid
CID 84712825
(2R)-2-amino-2-(2-chloro-6-methoxy-3-pyridinyl)acetic acid
CID 131214154
cyclopropyl-[4-(6-methoxy-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)piperidin-1-yl]methanone
CID 126855968
2-amino-2-(6-chloroimidazo[1,2-a]pyrazin-3-yl)acetic acid
CID 84690684
2-methoxy-7-methylpyrazolo[1,5-a]pyrimidine-6-carboxylic acid
CID 112756875
2-amino-2-(3-methoxy-1,2-oxazol-5-yl)acetic acid
CID 14238404
ethyl 6-methoxy-2-phenylimidazo[1,2-b]pyridazine-3-carboxylate
CID 14743340
(3S)-3-amino-3-(6-methoxy-3-pyridinyl)propanoic acid
CID 7016830
3-amino-3-(6-methoxy-3-pyridinyl)propanoic acid
CID 18000263
2-amino-2-(3-chloroimidazo[1,2-a]pyridin-5-yl)acetic acid
CID 83839723

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(6-methoxyimidazo[1,2-b]pyridazin-3-yl)acetic acid?
The IUPAC name of 2-amino-2-(6-methoxyimidazo[1,2-b]pyridazin-3-yl)acetic acid (CID 83890426) is 2-amino-2-(6-methoxyimidazo[1,2-b]pyridazin-3-yl)acetic acid.
What is the SMILES notation for 2-amino-2-(6-methoxyimidazo[1,2-b]pyridazin-3-yl)acetic acid?
The canonical SMILES for 2-amino-2-(6-methoxyimidazo[1,2-b]pyridazin-3-yl)acetic acid is COc1ccc2ncc(C(N)C(=O)O)n2n1.
What is the InChIKey of 2-amino-2-(6-methoxyimidazo[1,2-b]pyridazin-3-yl)acetic acid?
The InChIKey is LJHDDIZBYHYBLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4O3/c1-16-7-3-2-6-11-4-5(13(6)12-7)8(10)9(14)15/h2-4,8H,10H2,1H3,(H,14,15).
What are the key properties of 2-amino-2-(6-methoxyimidazo[1,2-b]pyridazin-3-yl)acetic acid?
2-amino-2-(6-methoxyimidazo[1,2-b]pyridazin-3-yl)acetic acid has a molecular weight of 222.20 g/mol, XLogP of -0.18, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(6-methoxyimidazo[1,2-b]pyridazin-3-yl)acetic acid is sourced from PubChem (CID 83890426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).