2-cyclohexyl-3-fluoro-2-methyl-5-(trifluoromethyl)piperidine

C13H21F4N — CID 162546680

IUPAC2-cyclohexyl-3-fluoro-2-methyl-5-(trifluoromethyl)piperidine
SMILESCC1(C2CCCCC2)NCC(C(F)(F)F)CC1F
InChIInChI=1S/C13H21F4N/c1-12(9-5-3-2-4-6-9)11(14)7-10(8-18-12)13(15,16)17/h9-11,18H,2-8H2,1H3
InChIKeyLGLCHAJEUXKUQT-UHFFFAOYSA-N
MW267.31 g/mol
LogP3.84
Rot. Bonds1

About 2-cyclohexyl-3-fluoro-2-methyl-5-(trifluoromethyl)piperidine

2-cyclohexyl-3-fluoro-2-methyl-5-(trifluoromethyl)piperidine (PubChem CID 162546680) has the molecular formula C13H21F4N and a molecular weight of 267.31 g/mol. Its IUPAC name is 2-cyclohexyl-3-fluoro-2-methyl-5-(trifluoromethyl)piperidine.

Molecular Properties

Compound Name2-cyclohexyl-3-fluoro-2-methyl-5-(trifluoromethyl)piperidine
PubChem CID162546680
Molecular FormulaC13H21F4N
Molecular Weight267.31 g/mol
Exact Mass267.16
IUPAC Name2-cyclohexyl-3-fluoro-2-methyl-5-(trifluoromethyl)piperidine
SMILESCC1(C2CCCCC2)NCC(C(F)(F)F)CC1F
InChIInChI=1S/C13H21F4N/c1-12(9-5-3-2-4-6-9)11(14)7-10(8-18-12)13(15,16)17/h9-11,18H,2-8H2,1H3
InChIKeyLGLCHAJEUXKUQT-UHFFFAOYSA-N
XLogP3.84
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.31
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-cyclohexyl-3-fluoro-2-methyl-5-(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

2-cyclohexyl-3-fluoro-2-methylpiperidine
CID 115021815
2-cycloheptyl-4-fluoro-2-methylpyrrolidine;hydrochloride
CID 115041274
1-cycloheptyl-4-(trifluoromethyl)cyclohexan-1-ol
CID 82927882
6-(trifluoromethyl)-4-azaspiro[2.5]octane
CID 136575476
5-cycloheptyl-5-methyltetrazolidine
CID 142825596
2-cycloheptyl-2-methylpiperidin-3-ol;hydrochloride
CID 115046240
(1-methylcyclopentyl)cyclohexane
CID 13217819
1-cycloheptyl-3-(trifluoromethyl)cycloheptan-1-ol
CID 152741278
(5R)-5-cyclohexyl-5-methyl-3-[[(3S)-3-(trifluoromethyl)piperidin-1-yl]methyl]imidazolidine-2,4-dione
CID 51887205
5-methyl-3-(trifluoromethyl)azepane
CID 176694469
2-cyclopentyl-2-methylpiperidin-3-ol
CID 115016550
2-fluoro-1-methyl-4-(trifluoromethyl)cyclohexane
CID 121477054

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-3-fluoro-2-methyl-5-(trifluoromethyl)piperidine?
The IUPAC name of 2-cyclohexyl-3-fluoro-2-methyl-5-(trifluoromethyl)piperidine (CID 162546680) is 2-cyclohexyl-3-fluoro-2-methyl-5-(trifluoromethyl)piperidine.
What is the SMILES notation for 2-cyclohexyl-3-fluoro-2-methyl-5-(trifluoromethyl)piperidine?
The canonical SMILES for 2-cyclohexyl-3-fluoro-2-methyl-5-(trifluoromethyl)piperidine is CC1(C2CCCCC2)NCC(C(F)(F)F)CC1F.
What is the InChIKey of 2-cyclohexyl-3-fluoro-2-methyl-5-(trifluoromethyl)piperidine?
The InChIKey is LGLCHAJEUXKUQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21F4N/c1-12(9-5-3-2-4-6-9)11(14)7-10(8-18-12)13(15,16)17/h9-11,18H,2-8H2,1H3.
What are the key properties of 2-cyclohexyl-3-fluoro-2-methyl-5-(trifluoromethyl)piperidine?
2-cyclohexyl-3-fluoro-2-methyl-5-(trifluoromethyl)piperidine has a molecular weight of 267.31 g/mol, XLogP of 3.84, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-3-fluoro-2-methyl-5-(trifluoromethyl)piperidine is sourced from PubChem (CID 162546680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).