3-methyl-6-(4-methylpiperidin-1-yl)pyridazine

C11H17N3 — CID 59712116

IUPAC3-methyl-6-(4-methylpiperidin-1-yl)pyridazine
SMILESCc1ccc(N2CCC(C)CC2)nn1
InChIInChI=1S/C11H17N3/c1-9-5-7-14(8-6-9)11-4-3-10(2)12-13-11/h3-4,9H,5-8H2,1-2H3
InChIKeyUMZFXMMMEVTMQK-UHFFFAOYSA-N
MW191.28 g/mol
LogP2.02
Rot. Bonds1

About 3-methyl-6-(4-methylpiperidin-1-yl)pyridazine

3-methyl-6-(4-methylpiperidin-1-yl)pyridazine (PubChem CID 59712116) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 3-methyl-6-(4-methylpiperidin-1-yl)pyridazine.

Molecular Properties

Compound Name3-methyl-6-(4-methylpiperidin-1-yl)pyridazine
PubChem CID59712116
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name3-methyl-6-(4-methylpiperidin-1-yl)pyridazine
SMILESCc1ccc(N2CCC(C)CC2)nn1
InChIInChI=1S/C11H17N3/c1-9-5-7-14(8-6-9)11-4-3-10(2)12-13-11/h3-4,9H,5-8H2,1-2H3
InChIKeyUMZFXMMMEVTMQK-UHFFFAOYSA-N
XLogP2.02
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 52.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-6-(4-methylpiperidin-1-yl)pyridazine?
The IUPAC name of 3-methyl-6-(4-methylpiperidin-1-yl)pyridazine (CID 59712116) is 3-methyl-6-(4-methylpiperidin-1-yl)pyridazine.
What is the SMILES notation for 3-methyl-6-(4-methylpiperidin-1-yl)pyridazine?
The canonical SMILES for 3-methyl-6-(4-methylpiperidin-1-yl)pyridazine is Cc1ccc(N2CCC(C)CC2)nn1.
What is the InChIKey of 3-methyl-6-(4-methylpiperidin-1-yl)pyridazine?
The InChIKey is UMZFXMMMEVTMQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-9-5-7-14(8-6-9)11-4-3-10(2)12-13-11/h3-4,9H,5-8H2,1-2H3.
What are the key properties of 3-methyl-6-(4-methylpiperidin-1-yl)pyridazine?
3-methyl-6-(4-methylpiperidin-1-yl)pyridazine has a molecular weight of 191.28 g/mol, XLogP of 2.02, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-6-(4-methylpiperidin-1-yl)pyridazine is sourced from PubChem (CID 59712116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).