N-ethyl-2-phenyl-1-[2-(trifluoromethyl)cyclohexyl]ethanamine

C17H24F3N — CID 104622288

IUPACN-ethyl-2-phenyl-1-[2-(trifluoromethyl)cyclohexyl]ethanamine
SMILESCCNC(Cc1ccccc1)C1CCCCC1C(F)(F)F
InChIInChI=1S/C17H24F3N/c1-2-21-16(12-13-8-4-3-5-9-13)14-10-6-7-11-15(14)17(18,19)20/h3-5,8-9,14-16,21H,2,6-7,10-12H2,1H3
InChIKeyYYTFVBWOSYDEMC-UHFFFAOYSA-N
MW299.38 g/mol
LogP4.58
Rot. Bonds5

About N-ethyl-2-phenyl-1-[2-(trifluoromethyl)cyclohexyl]ethanamine

N-ethyl-2-phenyl-1-[2-(trifluoromethyl)cyclohexyl]ethanamine (PubChem CID 104622288) has the molecular formula C17H24F3N and a molecular weight of 299.38 g/mol. Its IUPAC name is N-ethyl-2-phenyl-1-[2-(trifluoromethyl)cyclohexyl]ethanamine.

Molecular Properties

Compound NameN-ethyl-2-phenyl-1-[2-(trifluoromethyl)cyclohexyl]ethanamine
PubChem CID104622288
Molecular FormulaC17H24F3N
Molecular Weight299.38 g/mol
Exact Mass299.19
IUPAC NameN-ethyl-2-phenyl-1-[2-(trifluoromethyl)cyclohexyl]ethanamine
SMILESCCNC(Cc1ccccc1)C1CCCCC1C(F)(F)F
InChIInChI=1S/C17H24F3N/c1-2-21-16(12-13-8-4-3-5-9-13)14-10-6-7-11-15(14)17(18,19)20/h3-5,8-9,14-16,21H,2,6-7,10-12H2,1H3
InChIKeyYYTFVBWOSYDEMC-UHFFFAOYSA-N
XLogP4.58
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.38
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[2-bromo-2-[2-(trifluoromethyl)cyclohexyl]ethyl]benzene
CID 104622691
N-ethyl-2-propan-2-yloxy-1-[2-(trifluoromethyl)cyclohexyl]ethanamine
CID 105168105
N-ethyl-1-[2-(trifluoromethyl)cyclohexyl]pent-4-en-1-amine
CID 105153388
[2-(4-fluorophenyl)-1-[2-(trifluoromethyl)cyclohexyl]ethyl]hydrazine
CID 105283838
2-(2-fluorophenyl)-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]ethanamine
CID 104622284
1-(4,4-dimethylcyclohexyl)-N-ethyl-2-phenylethanamine
CID 65391828
N-[phenyl-[2-(trifluoromethyl)cyclohexyl]methyl]propan-1-amine
CID 105084116
4-cyclopentyl-N-ethyl-1-phenylbutan-2-amine
CID 63526556
[2-pyridin-3-yl-1-[2-(trifluoromethyl)cyclohexyl]ethyl]hydrazine
CID 105333794
N-ethyl-1-[2-(trifluoromethyl)cyclohexyl]hex-5-yn-1-amine
CID 105179551
N-ethyl-1-(3-ethylcyclopentyl)-2-phenylethanamine
CID 65412003
1-cyclobutyl-N-ethyl-2-[4-(trifluoromethyl)phenyl]ethanamine
CID 55040821

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-phenyl-1-[2-(trifluoromethyl)cyclohexyl]ethanamine?
The IUPAC name of N-ethyl-2-phenyl-1-[2-(trifluoromethyl)cyclohexyl]ethanamine (CID 104622288) is N-ethyl-2-phenyl-1-[2-(trifluoromethyl)cyclohexyl]ethanamine.
What is the SMILES notation for N-ethyl-2-phenyl-1-[2-(trifluoromethyl)cyclohexyl]ethanamine?
The canonical SMILES for N-ethyl-2-phenyl-1-[2-(trifluoromethyl)cyclohexyl]ethanamine is CCNC(Cc1ccccc1)C1CCCCC1C(F)(F)F.
What is the InChIKey of N-ethyl-2-phenyl-1-[2-(trifluoromethyl)cyclohexyl]ethanamine?
The InChIKey is YYTFVBWOSYDEMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24F3N/c1-2-21-16(12-13-8-4-3-5-9-13)14-10-6-7-11-15(14)17(18,19)20/h3-5,8-9,14-16,21H,2,6-7,10-12H2,1H3.
What are the key properties of N-ethyl-2-phenyl-1-[2-(trifluoromethyl)cyclohexyl]ethanamine?
N-ethyl-2-phenyl-1-[2-(trifluoromethyl)cyclohexyl]ethanamine has a molecular weight of 299.38 g/mol, XLogP of 4.58, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-phenyl-1-[2-(trifluoromethyl)cyclohexyl]ethanamine is sourced from PubChem (CID 104622288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).