3-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]-6-(trifluoromethyl)pyridazine

C19H27F3N4O — CID 11646684

IUPAC3-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]-6-(trifluoromethyl)pyridazine
SMILESFC(F)(F)c1ccc(N2CCC(OC3CCN(C4CCC4)CC3)CC2)nn1
InChIInChI=1S/C19H27F3N4O/c20-19(21,22)17-4-5-18(24-23-17)26-12-8-16(9-13-26)27-15-6-10-25(11-7-15)14-2-1-3-14/h4-5,14-16H,1-3,6-13H2
InChIKeyQLZASUPJZXESTL-UHFFFAOYSA-N
MW384.45 g/mol
LogP3.50
Rot. Bonds4

About 3-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]-6-(trifluoromethyl)pyridazine

3-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]-6-(trifluoromethyl)pyridazine (PubChem CID 11646684) has the molecular formula C19H27F3N4O and a molecular weight of 384.45 g/mol. Its IUPAC name is 3-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]-6-(trifluoromethyl)pyridazine.

Molecular Properties

Compound Name3-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]-6-(trifluoromethyl)pyridazine
PubChem CID11646684
Molecular FormulaC19H27F3N4O
Molecular Weight384.45 g/mol
Exact Mass384.21
IUPAC Name3-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]-6-(trifluoromethyl)pyridazine
SMILESFC(F)(F)c1ccc(N2CCC(OC3CCN(C4CCC4)CC3)CC2)nn1
InChIInChI=1S/C19H27F3N4O/c20-19(21,22)17-4-5-18(24-23-17)26-12-8-16(9-13-26)27-15-6-10-25(11-7-15)14-2-1-3-14/h4-5,14-16H,1-3,6-13H2
InChIKeyQLZASUPJZXESTL-UHFFFAOYSA-N
XLogP3.50
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.45
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 3-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]-6-(trifluoromethyl)pyridazine with MolForge

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

Launch Full Analysis

Related Compounds

3-(6-Methylpyridazin-3-yl)-9-(oxan-4-yl)-3,9-diazaspiro[5.5]undecane
CID 97450437
3-(6-Methylpyridazin-3-yl)-9-(oxolan-3-yl)-3,9-diazaspiro[5.5]undecane
CID 118742751
3-[4-(2-Methylpropoxy)piperidin-1-yl]-6-(trifluoromethyl)pyridazine
CID 136519197
3-[4-[(1-Cyclobutylpiperidin-4-yl)methyl]piperidin-1-yl]-6-(trifluoromethyl)pyridazine
CID 11501830
3-[4-[(1-Propan-2-ylpiperidin-4-yl)methyl]piperidin-1-yl]-6-(trifluoromethyl)pyridazine
CID 11660708
3-(4-{[1-(1-Methylethyl)-4-piperidinyl]oxy}-1-piperidinyl)-6-(trifluoromethyl)pyridazine
CID 58747957
3-{4-[(1-Cyclobutyl-4-piperidinyl)oxy]-1-piperidinyl}-6-(trifluoromethyl)pyridazine hydrochloride
CID 69354884
(3R,4S)-3-fluoro-1-(6-methylpyridazin-3-yl)piperidin-4-ol
CID 124116446
3,3-Difluoro-1-(6-methylpyridazin-3-yl)piperidin-4-ol
CID 124116458
1-(6-Tert-butylpyridazin-3-yl)-3,3-difluoropiperidin-4-ol
CID 134595647
4-[6-(Trifluoromethyl)pyridazin-3-yl]morpholine
CID 51064042
3-Piperidin-1-yl-6-(trifluoromethyl)pyridazine
CID 51064043

Frequently Asked Questions

What is the IUPAC name of 3-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]-6-(trifluoromethyl)pyridazine?
The IUPAC name of 3-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]-6-(trifluoromethyl)pyridazine (CID 11646684) is 3-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]-6-(trifluoromethyl)pyridazine.
What is the SMILES notation for 3-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]-6-(trifluoromethyl)pyridazine?
The canonical SMILES for 3-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]-6-(trifluoromethyl)pyridazine is FC(F)(F)c1ccc(N2CCC(OC3CCN(C4CCC4)CC3)CC2)nn1.
What is the InChIKey of 3-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]-6-(trifluoromethyl)pyridazine?
The InChIKey is QLZASUPJZXESTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27F3N4O/c20-19(21,22)17-4-5-18(24-23-17)26-12-8-16(9-13-26)27-15-6-10-25(11-7-15)14-2-1-3-14/h4-5,14-16H,1-3,6-13H2.
What are the key properties of 3-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]-6-(trifluoromethyl)pyridazine?
3-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]-6-(trifluoromethyl)pyridazine has a molecular weight of 384.45 g/mol, XLogP of 3.50, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]-6-(trifluoromethyl)pyridazine is sourced from PubChem (CID 11646684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).