4-ethyl-1-[[1-(trifluoromethyl)cyclohexyl]methyl]piperidine

C15H26F3N — CID 155470209

IUPAC4-ethyl-1-[[1-(trifluoromethyl)cyclohexyl]methyl]piperidine
SMILESCCC1CCN(CC2(C(F)(F)F)CCCCC2)CC1
InChIInChI=1S/C15H26F3N/c1-2-13-6-10-19(11-7-13)12-14(15(16,17)18)8-4-3-5-9-14/h13H,2-12H2,1H3
InChIKeyMQPQJQQSXBLDKG-UHFFFAOYSA-N
MW277.37 g/mol
LogP4.62
Rot. Bonds3

About 4-ethyl-1-[[1-(trifluoromethyl)cyclohexyl]methyl]piperidine

4-ethyl-1-[[1-(trifluoromethyl)cyclohexyl]methyl]piperidine (PubChem CID 155470209) has the molecular formula C15H26F3N and a molecular weight of 277.37 g/mol. Its IUPAC name is 4-ethyl-1-[[1-(trifluoromethyl)cyclohexyl]methyl]piperidine.

Molecular Properties

Compound Name4-ethyl-1-[[1-(trifluoromethyl)cyclohexyl]methyl]piperidine
PubChem CID155470209
Molecular FormulaC15H26F3N
Molecular Weight277.37 g/mol
Exact Mass277.20
IUPAC Name4-ethyl-1-[[1-(trifluoromethyl)cyclohexyl]methyl]piperidine
SMILESCCC1CCN(CC2(C(F)(F)F)CCCCC2)CC1
InChIInChI=1S/C15H26F3N/c1-2-13-6-10-19(11-7-13)12-14(15(16,17)18)8-4-3-5-9-14/h13H,2-12H2,1H3
InChIKeyMQPQJQQSXBLDKG-UHFFFAOYSA-N
XLogP4.62
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 54.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(3R)-N-methyl-1-[[1-(trifluoromethyl)cyclopropyl]methyl]pyrrolidin-3-amine
CID 167064829
1-(2,2-difluorobutyl)-4-ethylpiperidine
CID 123670670
2-iodo-5-[[1-[[1-(trifluoromethyl)cyclobutyl]methyl]piperidin-4-yl]methoxy]pyrazine
CID 90017965
1,4-diethylpiperidine;ethane
CID 143709904
N-[1-[(4-ethylpiperidin-1-yl)methyl]cyclohexyl]benzamide
CID 57179371
[1-[(4-propylpiperidin-1-yl)methyl]cyclopentyl]methanol
CID 55055613
1,4-diethylazepane
CID 67522864
N-[[1-[(3-ethylpyrrolidin-1-yl)methyl]cyclohexyl]methyl]ethanamine
CID 113418861
1-[[1-(bromomethyl)cyclohexyl]methyl]-4-propylazepane
CID 65006739
2-(4-prop-1-en-2-ylphenyl)-5-[2-[1-[[1-(trifluoromethyl)cyclobutyl]methyl]piperidin-4-yl]ethyl]pyridine
CID 138673024
1-[2-(4-ethylazepan-1-yl)ethyl]cyclopentan-1-amine
CID 64681225
5-cyclopropyl-2-fluoro-N-methylsulfanyl-4-[[1-[[1-(trifluoromethyl)cyclopentyl]methyl]piperidin-4-yl]methoxy]benzamide
CID 144850164

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-1-[[1-(trifluoromethyl)cyclohexyl]methyl]piperidine?
The IUPAC name of 4-ethyl-1-[[1-(trifluoromethyl)cyclohexyl]methyl]piperidine (CID 155470209) is 4-ethyl-1-[[1-(trifluoromethyl)cyclohexyl]methyl]piperidine.
What is the SMILES notation for 4-ethyl-1-[[1-(trifluoromethyl)cyclohexyl]methyl]piperidine?
The canonical SMILES for 4-ethyl-1-[[1-(trifluoromethyl)cyclohexyl]methyl]piperidine is CCC1CCN(CC2(C(F)(F)F)CCCCC2)CC1.
What is the InChIKey of 4-ethyl-1-[[1-(trifluoromethyl)cyclohexyl]methyl]piperidine?
The InChIKey is MQPQJQQSXBLDKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26F3N/c1-2-13-6-10-19(11-7-13)12-14(15(16,17)18)8-4-3-5-9-14/h13H,2-12H2,1H3.
What are the key properties of 4-ethyl-1-[[1-(trifluoromethyl)cyclohexyl]methyl]piperidine?
4-ethyl-1-[[1-(trifluoromethyl)cyclohexyl]methyl]piperidine has a molecular weight of 277.37 g/mol, XLogP of 4.62, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-1-[[1-(trifluoromethyl)cyclohexyl]methyl]piperidine is sourced from PubChem (CID 155470209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).