2-cyclobutyloxy-1-methyl-5-(trifluoromethyl)piperidine

C11H18F3NO — CID 167168378

IUPAC2-cyclobutyloxy-1-methyl-5-(trifluoromethyl)piperidine
SMILESCN1CC(C(F)(F)F)CCC1OC1CCC1
InChIInChI=1S/C11H18F3NO/c1-15-7-8(11(12,13)14)5-6-10(15)16-9-3-2-4-9/h8-10H,2-7H2,1H3
InChIKeyPEWDGSIEAOHUKX-UHFFFAOYSA-N
MW237.26 g/mol
LogP2.79
Rot. Bonds2

About 2-cyclobutyloxy-1-methyl-5-(trifluoromethyl)piperidine

2-cyclobutyloxy-1-methyl-5-(trifluoromethyl)piperidine (PubChem CID 167168378) has the molecular formula C11H18F3NO and a molecular weight of 237.26 g/mol. Its IUPAC name is 2-cyclobutyloxy-1-methyl-5-(trifluoromethyl)piperidine.

Molecular Properties

Compound Name2-cyclobutyloxy-1-methyl-5-(trifluoromethyl)piperidine
PubChem CID167168378
Molecular FormulaC11H18F3NO
Molecular Weight237.26 g/mol
Exact Mass237.13
IUPAC Name2-cyclobutyloxy-1-methyl-5-(trifluoromethyl)piperidine
SMILESCN1CC(C(F)(F)F)CCC1OC1CCC1
InChIInChI=1S/C11H18F3NO/c1-15-7-8(11(12,13)14)5-6-10(15)16-9-3-2-4-9/h8-10H,2-7H2,1H3
InChIKeyPEWDGSIEAOHUKX-UHFFFAOYSA-N
XLogP2.79
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 52.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyloxy-1-methyl-5-(trifluoromethyl)piperidine?
The IUPAC name of 2-cyclobutyloxy-1-methyl-5-(trifluoromethyl)piperidine (CID 167168378) is 2-cyclobutyloxy-1-methyl-5-(trifluoromethyl)piperidine.
What is the SMILES notation for 2-cyclobutyloxy-1-methyl-5-(trifluoromethyl)piperidine?
The canonical SMILES for 2-cyclobutyloxy-1-methyl-5-(trifluoromethyl)piperidine is CN1CC(C(F)(F)F)CCC1OC1CCC1.
What is the InChIKey of 2-cyclobutyloxy-1-methyl-5-(trifluoromethyl)piperidine?
The InChIKey is PEWDGSIEAOHUKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18F3NO/c1-15-7-8(11(12,13)14)5-6-10(15)16-9-3-2-4-9/h8-10H,2-7H2,1H3.
What are the key properties of 2-cyclobutyloxy-1-methyl-5-(trifluoromethyl)piperidine?
2-cyclobutyloxy-1-methyl-5-(trifluoromethyl)piperidine has a molecular weight of 237.26 g/mol, XLogP of 2.79, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyloxy-1-methyl-5-(trifluoromethyl)piperidine is sourced from PubChem (CID 167168378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).