4-methyl-6-[(6-methylpyridazin-3-yl)amino]pyridazine-3-carboxamide

C11H12N6O — CID 154630970

IUPAC4-methyl-6-[(6-methylpyridazin-3-yl)amino]pyridazine-3-carboxamide
SMILESCc1ccc(Nc2cc(C)c(C(N)=O)nn2)nn1
InChIInChI=1S/C11H12N6O/c1-6-5-9(16-17-10(6)11(12)18)13-8-4-3-7(2)14-15-8/h3-5H,1-2H3,(H2,12,18)(H,13,15,16)
InChIKeyHIZJDYVEPKWHBP-UHFFFAOYSA-N
MW244.26 g/mol
LogP0.73
Rot. Bonds3

About 4-methyl-6-[(6-methylpyridazin-3-yl)amino]pyridazine-3-carboxamide

4-methyl-6-[(6-methylpyridazin-3-yl)amino]pyridazine-3-carboxamide (PubChem CID 154630970) has the molecular formula C11H12N6O and a molecular weight of 244.26 g/mol. Its IUPAC name is 4-methyl-6-[(6-methylpyridazin-3-yl)amino]pyridazine-3-carboxamide.

Molecular Properties

Compound Name4-methyl-6-[(6-methylpyridazin-3-yl)amino]pyridazine-3-carboxamide
PubChem CID154630970
Molecular FormulaC11H12N6O
Molecular Weight244.26 g/mol
Exact Mass244.11
IUPAC Name4-methyl-6-[(6-methylpyridazin-3-yl)amino]pyridazine-3-carboxamide
SMILESCc1ccc(Nc2cc(C)c(C(N)=O)nn2)nn1
InChIInChI=1S/C11H12N6O/c1-6-5-9(16-17-10(6)11(12)18)13-8-4-3-7(2)14-15-8/h3-5H,1-2H3,(H2,12,18)(H,13,15,16)
InChIKeyHIZJDYVEPKWHBP-UHFFFAOYSA-N
XLogP0.73
TPSA106.68 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.26
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-6-[(6-methylpyridazin-3-yl)amino]pyridazine-3-carboxamide?
The IUPAC name of 4-methyl-6-[(6-methylpyridazin-3-yl)amino]pyridazine-3-carboxamide (CID 154630970) is 4-methyl-6-[(6-methylpyridazin-3-yl)amino]pyridazine-3-carboxamide.
What is the SMILES notation for 4-methyl-6-[(6-methylpyridazin-3-yl)amino]pyridazine-3-carboxamide?
The canonical SMILES for 4-methyl-6-[(6-methylpyridazin-3-yl)amino]pyridazine-3-carboxamide is Cc1ccc(Nc2cc(C)c(C(N)=O)nn2)nn1.
What is the InChIKey of 4-methyl-6-[(6-methylpyridazin-3-yl)amino]pyridazine-3-carboxamide?
The InChIKey is HIZJDYVEPKWHBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N6O/c1-6-5-9(16-17-10(6)11(12)18)13-8-4-3-7(2)14-15-8/h3-5H,1-2H3,(H2,12,18)(H,13,15,16).
What are the key properties of 4-methyl-6-[(6-methylpyridazin-3-yl)amino]pyridazine-3-carboxamide?
4-methyl-6-[(6-methylpyridazin-3-yl)amino]pyridazine-3-carboxamide has a molecular weight of 244.26 g/mol, XLogP of 0.73, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-6-[(6-methylpyridazin-3-yl)amino]pyridazine-3-carboxamide is sourced from PubChem (CID 154630970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).