N-ethyl-1-(5-methylpyridazin-3-yl)piperidin-3-amine

C12H20N4 — CID 106549225

IUPACN-ethyl-1-(5-methylpyridazin-3-yl)piperidin-3-amine
SMILESCCNC1CCCN(c2cc(C)cnn2)C1
InChIInChI=1S/C12H20N4/c1-3-13-11-5-4-6-16(9-11)12-7-10(2)8-14-15-12/h7-8,11,13H,3-6,9H2,1-2H3
InChIKeyVFFYMVKPFZOPRV-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.36
Rot. Bonds3

About N-ethyl-1-(5-methylpyridazin-3-yl)piperidin-3-amine

N-ethyl-1-(5-methylpyridazin-3-yl)piperidin-3-amine (PubChem CID 106549225) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is N-ethyl-1-(5-methylpyridazin-3-yl)piperidin-3-amine.

Molecular Properties

Compound NameN-ethyl-1-(5-methylpyridazin-3-yl)piperidin-3-amine
PubChem CID106549225
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC NameN-ethyl-1-(5-methylpyridazin-3-yl)piperidin-3-amine
SMILESCCNC1CCCN(c2cc(C)cnn2)C1
InChIInChI=1S/C12H20N4/c1-3-13-11-5-4-6-16(9-11)12-7-10(2)8-14-15-12/h7-8,11,13H,3-6,9H2,1-2H3
InChIKeyVFFYMVKPFZOPRV-UHFFFAOYSA-N
XLogP1.36
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 ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-ethyl-1-(5-methylpyridazin-3-yl)piperidin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(5-methylpyridazin-3-yl)piperidin-3-amine?
The IUPAC name of N-ethyl-1-(5-methylpyridazin-3-yl)piperidin-3-amine (CID 106549225) is N-ethyl-1-(5-methylpyridazin-3-yl)piperidin-3-amine.
What is the SMILES notation for N-ethyl-1-(5-methylpyridazin-3-yl)piperidin-3-amine?
The canonical SMILES for N-ethyl-1-(5-methylpyridazin-3-yl)piperidin-3-amine is CCNC1CCCN(c2cc(C)cnn2)C1.
What is the InChIKey of N-ethyl-1-(5-methylpyridazin-3-yl)piperidin-3-amine?
The InChIKey is VFFYMVKPFZOPRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-3-13-11-5-4-6-16(9-11)12-7-10(2)8-14-15-12/h7-8,11,13H,3-6,9H2,1-2H3.
What are the key properties of N-ethyl-1-(5-methylpyridazin-3-yl)piperidin-3-amine?
N-ethyl-1-(5-methylpyridazin-3-yl)piperidin-3-amine has a molecular weight of 220.32 g/mol, XLogP of 1.36, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(5-methylpyridazin-3-yl)piperidin-3-amine is sourced from PubChem (CID 106549225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).