N-ethyl-6-(1-methylpiperidin-4-yl)pyridazin-3-amine

C12H20N4 — CID 116973215

IUPACN-ethyl-6-(1-methylpiperidin-4-yl)pyridazin-3-amine
SMILESCCNc1ccc(C2CCN(C)CC2)nn1
InChIInChI=1S/C12H20N4/c1-3-13-12-5-4-11(14-15-12)10-6-8-16(2)9-7-10/h4-5,10H,3,6-9H2,1-2H3,(H,13,15)
InChIKeyVWNRSJIHTBOTGH-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.72
Rot. Bonds3

About N-ethyl-6-(1-methylpiperidin-4-yl)pyridazin-3-amine

N-ethyl-6-(1-methylpiperidin-4-yl)pyridazin-3-amine (PubChem CID 116973215) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is N-ethyl-6-(1-methylpiperidin-4-yl)pyridazin-3-amine.

Molecular Properties

Compound NameN-ethyl-6-(1-methylpiperidin-4-yl)pyridazin-3-amine
PubChem CID116973215
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC NameN-ethyl-6-(1-methylpiperidin-4-yl)pyridazin-3-amine
SMILESCCNc1ccc(C2CCN(C)CC2)nn1
InChIInChI=1S/C12H20N4/c1-3-13-12-5-4-11(14-15-12)10-6-8-16(2)9-7-10/h4-5,10H,3,6-9H2,1-2H3,(H,13,15)
InChIKeyVWNRSJIHTBOTGH-UHFFFAOYSA-N
XLogP1.72
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-(1-methylpiperidin-4-yl)pyridazin-3-amine?
The IUPAC name of N-ethyl-6-(1-methylpiperidin-4-yl)pyridazin-3-amine (CID 116973215) is N-ethyl-6-(1-methylpiperidin-4-yl)pyridazin-3-amine.
What is the SMILES notation for N-ethyl-6-(1-methylpiperidin-4-yl)pyridazin-3-amine?
The canonical SMILES for N-ethyl-6-(1-methylpiperidin-4-yl)pyridazin-3-amine is CCNc1ccc(C2CCN(C)CC2)nn1.
What is the InChIKey of N-ethyl-6-(1-methylpiperidin-4-yl)pyridazin-3-amine?
The InChIKey is VWNRSJIHTBOTGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-3-13-12-5-4-11(14-15-12)10-6-8-16(2)9-7-10/h4-5,10H,3,6-9H2,1-2H3,(H,13,15).
What are the key properties of N-ethyl-6-(1-methylpiperidin-4-yl)pyridazin-3-amine?
N-ethyl-6-(1-methylpiperidin-4-yl)pyridazin-3-amine has a molecular weight of 220.32 g/mol, XLogP of 1.72, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-(1-methylpiperidin-4-yl)pyridazin-3-amine is sourced from PubChem (CID 116973215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).