6-(5-ethyl-2-pyridinyl)-5-methyl-N-(1-methylpiperidin-3-yl)pyridazin-3-amine

C18H25N5 — CID 175435295

IUPAC6-(5-ethyl-2-pyridinyl)-5-methyl-N-(1-methylpiperidin-3-yl)pyridazin-3-amine
SMILESCCc1ccc(-c2nnc(NC3CCCN(C)C3)cc2C)nc1
InChIInChI=1S/C18H25N5/c1-4-14-7-8-16(19-11-14)18-13(2)10-17(21-22-18)20-15-6-5-9-23(3)12-15/h7-8,10-11,15H,4-6,9,12H2,1-3H3,(H,20,21)
InChIKeyTYPVAYKPUUZRQK-UHFFFAOYSA-N
MW311.43 g/mol
LogP2.92
Rot. Bonds4

About 6-(5-ethyl-2-pyridinyl)-5-methyl-N-(1-methylpiperidin-3-yl)pyridazin-3-amine

6-(5-ethyl-2-pyridinyl)-5-methyl-N-(1-methylpiperidin-3-yl)pyridazin-3-amine (PubChem CID 175435295) has the molecular formula C18H25N5 and a molecular weight of 311.43 g/mol. Its IUPAC name is 6-(5-ethyl-2-pyridinyl)-5-methyl-N-(1-methylpiperidin-3-yl)pyridazin-3-amine.

Molecular Properties

Compound Name6-(5-ethyl-2-pyridinyl)-5-methyl-N-(1-methylpiperidin-3-yl)pyridazin-3-amine
PubChem CID175435295
Molecular FormulaC18H25N5
Molecular Weight311.43 g/mol
Exact Mass311.21
IUPAC Name6-(5-ethyl-2-pyridinyl)-5-methyl-N-(1-methylpiperidin-3-yl)pyridazin-3-amine
SMILESCCc1ccc(-c2nnc(NC3CCCN(C)C3)cc2C)nc1
InChIInChI=1S/C18H25N5/c1-4-14-7-8-16(19-11-14)18-13(2)10-17(21-22-18)20-15-6-5-9-23(3)12-15/h7-8,10-11,15H,4-6,9,12H2,1-3H3,(H,20,21)
InChIKeyTYPVAYKPUUZRQK-UHFFFAOYSA-N
XLogP2.92
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(5-ethyl-2-pyridinyl)-5-methyl-N-(1-methylpiperidin-3-yl)pyridazin-3-amine?
The IUPAC name of 6-(5-ethyl-2-pyridinyl)-5-methyl-N-(1-methylpiperidin-3-yl)pyridazin-3-amine (CID 175435295) is 6-(5-ethyl-2-pyridinyl)-5-methyl-N-(1-methylpiperidin-3-yl)pyridazin-3-amine.
What is the SMILES notation for 6-(5-ethyl-2-pyridinyl)-5-methyl-N-(1-methylpiperidin-3-yl)pyridazin-3-amine?
The canonical SMILES for 6-(5-ethyl-2-pyridinyl)-5-methyl-N-(1-methylpiperidin-3-yl)pyridazin-3-amine is CCc1ccc(-c2nnc(NC3CCCN(C)C3)cc2C)nc1.
What is the InChIKey of 6-(5-ethyl-2-pyridinyl)-5-methyl-N-(1-methylpiperidin-3-yl)pyridazin-3-amine?
The InChIKey is TYPVAYKPUUZRQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N5/c1-4-14-7-8-16(19-11-14)18-13(2)10-17(21-22-18)20-15-6-5-9-23(3)12-15/h7-8,10-11,15H,4-6,9,12H2,1-3H3,(H,20,21).
What are the key properties of 6-(5-ethyl-2-pyridinyl)-5-methyl-N-(1-methylpiperidin-3-yl)pyridazin-3-amine?
6-(5-ethyl-2-pyridinyl)-5-methyl-N-(1-methylpiperidin-3-yl)pyridazin-3-amine has a molecular weight of 311.43 g/mol, XLogP of 2.92, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-ethyl-2-pyridinyl)-5-methyl-N-(1-methylpiperidin-3-yl)pyridazin-3-amine is sourced from PubChem (CID 175435295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).