3-(azetidin-3-yl)-4,5,6-trimethylpyridazine;ethane

C14H27N3 — CID 169124293

IUPAC3-(azetidin-3-yl)-4,5,6-trimethylpyridazine;ethane
SMILESCC.CC.Cc1nnc(C2CNC2)c(C)c1C
InChIInChI=1S/C10H15N3.2C2H6/c1-6-7(2)10(9-4-11-5-9)13-12-8(6)3;2*1-2/h9,11H,4-5H2,1-3H3;2*1-2H3
InChIKeyKOJXLEBEQAEKIK-UHFFFAOYSA-N
MW237.39 g/mol
LogP3.14
Rot. Bonds1

About 3-(azetidin-3-yl)-4,5,6-trimethylpyridazine;ethane

3-(azetidin-3-yl)-4,5,6-trimethylpyridazine;ethane (PubChem CID 169124293) has the molecular formula C14H27N3 and a molecular weight of 237.39 g/mol. Its IUPAC name is 3-(azetidin-3-yl)-4,5,6-trimethylpyridazine;ethane.

Molecular Properties

Compound Name3-(azetidin-3-yl)-4,5,6-trimethylpyridazine;ethane
PubChem CID169124293
Molecular FormulaC14H27N3
Molecular Weight237.39 g/mol
Exact Mass237.22
IUPAC Name3-(azetidin-3-yl)-4,5,6-trimethylpyridazine;ethane
SMILESCC.CC.Cc1nnc(C2CNC2)c(C)c1C
InChIInChI=1S/C10H15N3.2C2H6/c1-6-7(2)10(9-4-11-5-9)13-12-8(6)3;2*1-2/h9,11H,4-5H2,1-3H3;2*1-2H3
InChIKeyKOJXLEBEQAEKIK-UHFFFAOYSA-N
XLogP3.14
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.39
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(azetidin-3-yl)-4,5,6-trimethylpyridazine;ethane 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 3-(azetidin-3-yl)-4,5,6-trimethylpyridazine;ethane?
The IUPAC name of 3-(azetidin-3-yl)-4,5,6-trimethylpyridazine;ethane (CID 169124293) is 3-(azetidin-3-yl)-4,5,6-trimethylpyridazine;ethane.
What is the SMILES notation for 3-(azetidin-3-yl)-4,5,6-trimethylpyridazine;ethane?
The canonical SMILES for 3-(azetidin-3-yl)-4,5,6-trimethylpyridazine;ethane is CC.CC.Cc1nnc(C2CNC2)c(C)c1C.
What is the InChIKey of 3-(azetidin-3-yl)-4,5,6-trimethylpyridazine;ethane?
The InChIKey is KOJXLEBEQAEKIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3.2C2H6/c1-6-7(2)10(9-4-11-5-9)13-12-8(6)3;2*1-2/h9,11H,4-5H2,1-3H3;2*1-2H3.
What are the key properties of 3-(azetidin-3-yl)-4,5,6-trimethylpyridazine;ethane?
3-(azetidin-3-yl)-4,5,6-trimethylpyridazine;ethane has a molecular weight of 237.39 g/mol, XLogP of 3.14, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(azetidin-3-yl)-4,5,6-trimethylpyridazine;ethane is sourced from PubChem (CID 169124293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).