3-(methylamino)pyridazine-4-carboxamide

C6H8N4O — CID 66829244

IUPAC3-(methylamino)pyridazine-4-carboxamide
SMILESCNc1nnccc1C(N)=O
InChIInChI=1S/C6H8N4O/c1-8-6-4(5(7)11)2-3-9-10-6/h2-3H,1H3,(H2,7,11)(H,8,10)
InChIKeyAOEGKMCJAPVRSF-UHFFFAOYSA-N
MW152.16 g/mol
LogP-0.38
Rot. Bonds2

About 3-(methylamino)pyridazine-4-carboxamide

3-(methylamino)pyridazine-4-carboxamide (PubChem CID 66829244) has the molecular formula C6H8N4O and a molecular weight of 152.16 g/mol. Its IUPAC name is 3-(methylamino)pyridazine-4-carboxamide.

Molecular Properties

Compound Name3-(methylamino)pyridazine-4-carboxamide
PubChem CID66829244
Molecular FormulaC6H8N4O
Molecular Weight152.16 g/mol
Exact Mass152.07
IUPAC Name3-(methylamino)pyridazine-4-carboxamide
SMILESCNc1nnccc1C(N)=O
InChIInChI=1S/C6H8N4O/c1-8-6-4(5(7)11)2-3-9-10-6/h2-3H,1H3,(H2,7,11)(H,8,10)
InChIKeyAOEGKMCJAPVRSF-UHFFFAOYSA-N
XLogP-0.38
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.16
LogP ≤ 5-0.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(methylamino)pyridazine-4-carboxamide?
The IUPAC name of 3-(methylamino)pyridazine-4-carboxamide (CID 66829244) is 3-(methylamino)pyridazine-4-carboxamide.
What is the SMILES notation for 3-(methylamino)pyridazine-4-carboxamide?
The canonical SMILES for 3-(methylamino)pyridazine-4-carboxamide is CNc1nnccc1C(N)=O.
What is the InChIKey of 3-(methylamino)pyridazine-4-carboxamide?
The InChIKey is AOEGKMCJAPVRSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N4O/c1-8-6-4(5(7)11)2-3-9-10-6/h2-3H,1H3,(H2,7,11)(H,8,10).
What are the key properties of 3-(methylamino)pyridazine-4-carboxamide?
3-(methylamino)pyridazine-4-carboxamide has a molecular weight of 152.16 g/mol, XLogP of -0.38, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methylamino)pyridazine-4-carboxamide is sourced from PubChem (CID 66829244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).