3-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine

C15H24N6 — CID 39339122

IUPAC3-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine
SMILESCc1nnc2ccc(NC3CC(C)(C)NC(C)(C)C3)nn12
InChIInChI=1S/C15H24N6/c1-10-17-18-13-7-6-12(19-21(10)13)16-11-8-14(2,3)20-15(4,5)9-11/h6-7,11,20H,8-9H2,1-5H3,(H,16,19)
InChIKeySHLUTQZDJGLVGD-UHFFFAOYSA-N
MW288.40 g/mol
LogP2.15
Rot. Bonds2

About 3-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine

3-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine (PubChem CID 39339122) has the molecular formula C15H24N6 and a molecular weight of 288.40 g/mol. Its IUPAC name is 3-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine.

Molecular Properties

Compound Name3-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine
PubChem CID39339122
Molecular FormulaC15H24N6
Molecular Weight288.40 g/mol
Exact Mass288.21
IUPAC Name3-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine
SMILESCc1nnc2ccc(NC3CC(C)(C)NC(C)(C)C3)nn12
InChIInChI=1S/C15H24N6/c1-10-17-18-13-7-6-12(19-21(10)13)16-11-8-14(2,3)20-15(4,5)9-11/h6-7,11,20H,8-9H2,1-5H3,(H,16,19)
InChIKeySHLUTQZDJGLVGD-UHFFFAOYSA-N
XLogP2.15
TPSA67.14 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.40
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine?
The IUPAC name of 3-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine (CID 39339122) is 3-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine.
What is the SMILES notation for 3-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine?
The canonical SMILES for 3-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine is Cc1nnc2ccc(NC3CC(C)(C)NC(C)(C)C3)nn12.
What is the InChIKey of 3-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine?
The InChIKey is SHLUTQZDJGLVGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N6/c1-10-17-18-13-7-6-12(19-21(10)13)16-11-8-14(2,3)20-15(4,5)9-11/h6-7,11,20H,8-9H2,1-5H3,(H,16,19).
What are the key properties of 3-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine?
3-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine has a molecular weight of 288.40 g/mol, XLogP of 2.15, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine is sourced from PubChem (CID 39339122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).