2-amino-N-methylimidazo[1,2-b]pyridazine-3-carboxamide

C8H9N5O — CID 145057040

IUPAC2-amino-N-methylimidazo[1,2-b]pyridazine-3-carboxamide
SMILESCNC(=O)c1c(N)nc2cccnn12
InChIInChI=1S/C8H9N5O/c1-10-8(14)6-7(9)12-5-3-2-4-11-13(5)6/h2-4H,9H2,1H3,(H,10,14)
InChIKeyKLKSMTYMGBBQNP-UHFFFAOYSA-N
MW191.19 g/mol
LogP-0.33
Rot. Bonds1

About 2-amino-N-methylimidazo[1,2-b]pyridazine-3-carboxamide

2-amino-N-methylimidazo[1,2-b]pyridazine-3-carboxamide (PubChem CID 145057040) has the molecular formula C8H9N5O and a molecular weight of 191.19 g/mol. Its IUPAC name is 2-amino-N-methylimidazo[1,2-b]pyridazine-3-carboxamide.

Molecular Properties

Compound Name2-amino-N-methylimidazo[1,2-b]pyridazine-3-carboxamide
PubChem CID145057040
Molecular FormulaC8H9N5O
Molecular Weight191.19 g/mol
Exact Mass191.08
IUPAC Name2-amino-N-methylimidazo[1,2-b]pyridazine-3-carboxamide
SMILESCNC(=O)c1c(N)nc2cccnn12
InChIInChI=1S/C8H9N5O/c1-10-8(14)6-7(9)12-5-3-2-4-11-13(5)6/h2-4H,9H2,1H3,(H,10,14)
InChIKeyKLKSMTYMGBBQNP-UHFFFAOYSA-N
XLogP-0.33
TPSA85.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.19
LogP ≤ 5-0.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-methylimidazo[1,2-b]pyridazine-3-carboxamide?
The IUPAC name of 2-amino-N-methylimidazo[1,2-b]pyridazine-3-carboxamide (CID 145057040) is 2-amino-N-methylimidazo[1,2-b]pyridazine-3-carboxamide.
What is the SMILES notation for 2-amino-N-methylimidazo[1,2-b]pyridazine-3-carboxamide?
The canonical SMILES for 2-amino-N-methylimidazo[1,2-b]pyridazine-3-carboxamide is CNC(=O)c1c(N)nc2cccnn12.
What is the InChIKey of 2-amino-N-methylimidazo[1,2-b]pyridazine-3-carboxamide?
The InChIKey is KLKSMTYMGBBQNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N5O/c1-10-8(14)6-7(9)12-5-3-2-4-11-13(5)6/h2-4H,9H2,1H3,(H,10,14).
What are the key properties of 2-amino-N-methylimidazo[1,2-b]pyridazine-3-carboxamide?
2-amino-N-methylimidazo[1,2-b]pyridazine-3-carboxamide has a molecular weight of 191.19 g/mol, XLogP of -0.33, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-methylimidazo[1,2-b]pyridazine-3-carboxamide is sourced from PubChem (CID 145057040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).