1-(5,5-dimethyloxolan-3-yl)-4-propan-2-yl-4-(trifluoromethyl)piperidine

C15H26F3NO — CID 170588302

IUPAC1-(5,5-dimethyloxolan-3-yl)-4-propan-2-yl-4-(trifluoromethyl)piperidine
SMILESCC(C)C1(C(F)(F)F)CCN(C2COC(C)(C)C2)CC1
InChIInChI=1S/C15H26F3NO/c1-11(2)14(15(16,17)18)5-7-19(8-6-14)12-9-13(3,4)20-10-12/h11-12H,5-10H2,1-4H3
InChIKeyJJYOSJPFPXNGLK-UHFFFAOYSA-N
MW293.37 g/mol
LogP3.85
Rot. Bonds2

About 1-(5,5-dimethyloxolan-3-yl)-4-propan-2-yl-4-(trifluoromethyl)piperidine

1-(5,5-dimethyloxolan-3-yl)-4-propan-2-yl-4-(trifluoromethyl)piperidine (PubChem CID 170588302) has the molecular formula C15H26F3NO and a molecular weight of 293.37 g/mol. Its IUPAC name is 1-(5,5-dimethyloxolan-3-yl)-4-propan-2-yl-4-(trifluoromethyl)piperidine.

Molecular Properties

Compound Name1-(5,5-dimethyloxolan-3-yl)-4-propan-2-yl-4-(trifluoromethyl)piperidine
PubChem CID170588302
Molecular FormulaC15H26F3NO
Molecular Weight293.37 g/mol
Exact Mass293.20
IUPAC Name1-(5,5-dimethyloxolan-3-yl)-4-propan-2-yl-4-(trifluoromethyl)piperidine
SMILESCC(C)C1(C(F)(F)F)CCN(C2COC(C)(C)C2)CC1
InChIInChI=1S/C15H26F3NO/c1-11(2)14(15(16,17)18)5-7-19(8-6-14)12-9-13(3,4)20-10-12/h11-12H,5-10H2,1-4H3
InChIKeyJJYOSJPFPXNGLK-UHFFFAOYSA-N
XLogP3.85
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-(5,5-dimethyloxolan-3-yl)-4-propan-2-yl-4-(trifluoromethyl)piperidine 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 1-(5,5-dimethyloxolan-3-yl)-4-propan-2-yl-4-(trifluoromethyl)piperidine?
The IUPAC name of 1-(5,5-dimethyloxolan-3-yl)-4-propan-2-yl-4-(trifluoromethyl)piperidine (CID 170588302) is 1-(5,5-dimethyloxolan-3-yl)-4-propan-2-yl-4-(trifluoromethyl)piperidine.
What is the SMILES notation for 1-(5,5-dimethyloxolan-3-yl)-4-propan-2-yl-4-(trifluoromethyl)piperidine?
The canonical SMILES for 1-(5,5-dimethyloxolan-3-yl)-4-propan-2-yl-4-(trifluoromethyl)piperidine is CC(C)C1(C(F)(F)F)CCN(C2COC(C)(C)C2)CC1.
What is the InChIKey of 1-(5,5-dimethyloxolan-3-yl)-4-propan-2-yl-4-(trifluoromethyl)piperidine?
The InChIKey is JJYOSJPFPXNGLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26F3NO/c1-11(2)14(15(16,17)18)5-7-19(8-6-14)12-9-13(3,4)20-10-12/h11-12H,5-10H2,1-4H3.
What are the key properties of 1-(5,5-dimethyloxolan-3-yl)-4-propan-2-yl-4-(trifluoromethyl)piperidine?
1-(5,5-dimethyloxolan-3-yl)-4-propan-2-yl-4-(trifluoromethyl)piperidine has a molecular weight of 293.37 g/mol, XLogP of 3.85, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5,5-dimethyloxolan-3-yl)-4-propan-2-yl-4-(trifluoromethyl)piperidine is sourced from PubChem (CID 170588302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).