2-(2-ethylhexyl)-6-(trifluoromethyl)piperidine

C14H26F3N — CID 106777958

IUPAC2-(2-ethylhexyl)-6-(trifluoromethyl)piperidine
SMILESCCCCC(CC)CC1CCCC(C(F)(F)F)N1
InChIInChI=1S/C14H26F3N/c1-3-5-7-11(4-2)10-12-8-6-9-13(18-12)14(15,16)17/h11-13,18H,3-10H2,1-2H3
InChIKeyXCAOQHBFWVEILP-UHFFFAOYSA-N
MW265.36 g/mol
LogP4.67
Rot. Bonds6

About 2-(2-ethylhexyl)-6-(trifluoromethyl)piperidine

2-(2-ethylhexyl)-6-(trifluoromethyl)piperidine (PubChem CID 106777958) has the molecular formula C14H26F3N and a molecular weight of 265.36 g/mol. Its IUPAC name is 2-(2-ethylhexyl)-6-(trifluoromethyl)piperidine.

Molecular Properties

Compound Name2-(2-ethylhexyl)-6-(trifluoromethyl)piperidine
PubChem CID106777958
Molecular FormulaC14H26F3N
Molecular Weight265.36 g/mol
Exact Mass265.20
IUPAC Name2-(2-ethylhexyl)-6-(trifluoromethyl)piperidine
SMILESCCCCC(CC)CC1CCCC(C(F)(F)F)N1
InChIInChI=1S/C14H26F3N/c1-3-5-7-11(4-2)10-12-8-6-9-13(18-12)14(15,16)17/h11-13,18H,3-10H2,1-2H3
InChIKeyXCAOQHBFWVEILP-UHFFFAOYSA-N
XLogP4.67
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 54.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-(2-ethylhexyl)-6-(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

Related Compounds

(2R,6R)-2,6-bis(trifluoromethyl)piperidine
CID 96551753
(2R)-1-[(2S,6R)-6-[(2R)-2-hydroxyhexyl]piperidin-2-yl]hexan-2-ol
CID 11108896
2-(2-ethylbutyl)-6-methylpiperidine
CID 106781072
2-(3,3-dimethylbutyl)-6-(trifluoromethyl)piperidine
CID 106778866
2-(2-ethylhexyl)-N-methylcyclopentan-1-amine
CID 63400350
2-(trifluoromethyl)-6-(3,3,3-trifluoropropyl)piperidine
CID 106779737
1,3-bis(2-ethylhexyl)cyclohexane;oxirane
CID 88727038
3-(2-ethylhexyl)azepane
CID 104680647
2-(2-ethylhexoxy)cyclohexan-1-amine
CID 43127678
2-(2-ethylhexyl)oxetane
CID 158420180
(2R,6R)-2-methyl-6-(trifluoromethyl)piperidine
CID 95366768
1,1,2-tris(2-ethylhexyl)cyclohexane
CID 155657580

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylhexyl)-6-(trifluoromethyl)piperidine?
The IUPAC name of 2-(2-ethylhexyl)-6-(trifluoromethyl)piperidine (CID 106777958) is 2-(2-ethylhexyl)-6-(trifluoromethyl)piperidine.
What is the SMILES notation for 2-(2-ethylhexyl)-6-(trifluoromethyl)piperidine?
The canonical SMILES for 2-(2-ethylhexyl)-6-(trifluoromethyl)piperidine is CCCCC(CC)CC1CCCC(C(F)(F)F)N1.
What is the InChIKey of 2-(2-ethylhexyl)-6-(trifluoromethyl)piperidine?
The InChIKey is XCAOQHBFWVEILP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26F3N/c1-3-5-7-11(4-2)10-12-8-6-9-13(18-12)14(15,16)17/h11-13,18H,3-10H2,1-2H3.
What are the key properties of 2-(2-ethylhexyl)-6-(trifluoromethyl)piperidine?
2-(2-ethylhexyl)-6-(trifluoromethyl)piperidine has a molecular weight of 265.36 g/mol, XLogP of 4.67, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylhexyl)-6-(trifluoromethyl)piperidine is sourced from PubChem (CID 106777958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).