2,2-dimethyl-1-[[3-(trifluoromethyl)phenyl]methyl]cyclohexan-1-amine

C16H22F3N — CID 79834786

IUPAC2,2-dimethyl-1-[[3-(trifluoromethyl)phenyl]methyl]cyclohexan-1-amine
SMILESCC1(C)CCCCC1(N)Cc1cccc(C(F)(F)F)c1
InChIInChI=1S/C16H22F3N/c1-14(2)8-3-4-9-15(14,20)11-12-6-5-7-13(10-12)16(17,18)19/h5-7,10H,3-4,8-9,11,20H2,1-2H3
InChIKeyGGBVXAGAMYDJDT-UHFFFAOYSA-N
MW285.35 g/mol
LogP4.55
Rot. Bonds2

About 2,2-dimethyl-1-[[3-(trifluoromethyl)phenyl]methyl]cyclohexan-1-amine

2,2-dimethyl-1-[[3-(trifluoromethyl)phenyl]methyl]cyclohexan-1-amine (PubChem CID 79834786) has the molecular formula C16H22F3N and a molecular weight of 285.35 g/mol. Its IUPAC name is 2,2-dimethyl-1-[[3-(trifluoromethyl)phenyl]methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-1-[[3-(trifluoromethyl)phenyl]methyl]cyclohexan-1-amine
PubChem CID79834786
Molecular FormulaC16H22F3N
Molecular Weight285.35 g/mol
Exact Mass285.17
IUPAC Name2,2-dimethyl-1-[[3-(trifluoromethyl)phenyl]methyl]cyclohexan-1-amine
SMILESCC1(C)CCCCC1(N)Cc1cccc(C(F)(F)F)c1
InChIInChI=1S/C16H22F3N/c1-14(2)8-3-4-9-15(14,20)11-12-6-5-7-13(10-12)16(17,18)19/h5-7,10H,3-4,8-9,11,20H2,1-2H3
InChIKeyGGBVXAGAMYDJDT-UHFFFAOYSA-N
XLogP4.55
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2,2-dimethyl-1-[[3-(trifluoromethyl)phenyl]methyl]cyclohexan-1-amine 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

1-[[3-(trifluoromethyl)phenyl]methyl]cycloheptan-1-amine
CID 62621040
1-benzyl-2,2-dimethylcyclohexan-1-amine
CID 79836797
1-[[1-(chloromethyl)cyclopentyl]methyl]-3-(trifluoromethyl)benzene
CID 66034453
2-methyl-2-[[3-(trifluoromethyl)phenyl]methyl]piperidine
CID 115058938
1-[[3-(trifluoromethyl)phenyl]methyl]cycloheptane-1-carbonitrile
CID 65389527
1-[[3-(trifluoromethyl)phenyl]methyl]cyclohexane-1-carboxamide
CID 23027904
1-(1-aminocyclohexyl)-3-[3-(trifluoromethyl)phenyl]propan-2-one
CID 116578964
1-methyl-N-[[3-(trifluoromethyl)phenyl]methyl]cyclobutan-1-amine
CID 115765833
2-ethyl-1-[[3-(trifluoromethyl)phenyl]methyl]cyclohexan-1-ol
CID 65149544
[2-[[3-(trifluoromethyl)phenyl]methyl]thiolan-2-yl]methanamine
CID 83173473
2,4-dimethyl-1-[1-[[3-(trifluoromethyl)phenyl]methyl]cyclopropyl]benzene
CID 174050173
N-[[1-[[3-(trifluoromethyl)phenyl]methyl]cyclopentyl]methyl]cyclopropanamine
CID 62723191

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-1-[[3-(trifluoromethyl)phenyl]methyl]cyclohexan-1-amine?
The IUPAC name of 2,2-dimethyl-1-[[3-(trifluoromethyl)phenyl]methyl]cyclohexan-1-amine (CID 79834786) is 2,2-dimethyl-1-[[3-(trifluoromethyl)phenyl]methyl]cyclohexan-1-amine.
What is the SMILES notation for 2,2-dimethyl-1-[[3-(trifluoromethyl)phenyl]methyl]cyclohexan-1-amine?
The canonical SMILES for 2,2-dimethyl-1-[[3-(trifluoromethyl)phenyl]methyl]cyclohexan-1-amine is CC1(C)CCCCC1(N)Cc1cccc(C(F)(F)F)c1.
What is the InChIKey of 2,2-dimethyl-1-[[3-(trifluoromethyl)phenyl]methyl]cyclohexan-1-amine?
The InChIKey is GGBVXAGAMYDJDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22F3N/c1-14(2)8-3-4-9-15(14,20)11-12-6-5-7-13(10-12)16(17,18)19/h5-7,10H,3-4,8-9,11,20H2,1-2H3.
What are the key properties of 2,2-dimethyl-1-[[3-(trifluoromethyl)phenyl]methyl]cyclohexan-1-amine?
2,2-dimethyl-1-[[3-(trifluoromethyl)phenyl]methyl]cyclohexan-1-amine has a molecular weight of 285.35 g/mol, XLogP of 4.55, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-1-[[3-(trifluoromethyl)phenyl]methyl]cyclohexan-1-amine is sourced from PubChem (CID 79834786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).