(3R)-1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-3-amine

C13H17F3N2 — CID 24904810

IUPAC(3R)-1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-3-amine
SMILESN[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1
InChIInChI=1S/C13H17F3N2/c14-13(15,16)11-4-1-3-10(7-11)8-18-6-2-5-12(17)9-18/h1,3-4,7,12H,2,5-6,8-9,17H2/t12-/m1/s1
InChIKeyUIOGNJDOOMVHAP-GFCCVEGCSA-N
MW258.29 g/mol
LogP2.63
Rot. Bonds2

About (3R)-1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-3-amine

(3R)-1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-3-amine (PubChem CID 24904810) has the molecular formula C13H17F3N2 and a molecular weight of 258.29 g/mol. Its IUPAC name is (3R)-1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-3-amine.

Molecular Properties

Compound Name(3R)-1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-3-amine
PubChem CID24904810
Molecular FormulaC13H17F3N2
Molecular Weight258.29 g/mol
Exact Mass258.13
IUPAC Name(3R)-1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-3-amine
SMILESN[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1
InChIInChI=1S/C13H17F3N2/c14-13(15,16)11-4-1-3-10(7-11)8-18-6-2-5-12(17)9-18/h1,3-4,7,12H,2,5-6,8-9,17H2/t12-/m1/s1
InChIKeyUIOGNJDOOMVHAP-GFCCVEGCSA-N
XLogP2.63
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.29
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (3R)-1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-3-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

(3R)-1-[[3-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-amine;hydrochloride
CID 119905166
1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-3-ol
CID 5180021
3-chloro-1-[[3-(trifluoromethyl)phenyl]methyl]piperidine
CID 63386578
(3R)-1-[(3-fluorophenyl)methyl]piperidin-3-amine
CID 24904616
(3R)-1-[[3-(trifluoromethyl)phenyl]methyl]piperidine-3-carboxamide
CID 30980962
(3R)-1-[[3-(trifluoromethyl)phenyl]methyl]piperidine-3-carboxylic acid
CID 24904811
(3S)-1-[(3-methylphenyl)methyl]piperidin-3-amine
CID 24904607
3-bromo-1-[[3-(trifluoromethyl)phenyl]methyl]pyrrolidine
CID 80677072
1-[[2-methyl-4-(trifluoromethyl)phenyl]methyl]piperidin-3-amine
CID 120834769
(3S)-3-pyrrolidin-1-yl-1-[[3-(trifluoromethyl)phenyl]methyl]pyrrolidine
CID 52878093
1-[[4-chloro-3-(trifluoromethyl)phenyl]methyl]piperidin-3-amine;hydrochloride
CID 119034117
1-benzyl-3-[3-(trifluoromethyl)phenyl]piperidine;hydrochloride
CID 3049036

Frequently Asked Questions

What is the IUPAC name of (3R)-1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-3-amine?
The IUPAC name of (3R)-1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-3-amine (CID 24904810) is (3R)-1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-3-amine.
What is the SMILES notation for (3R)-1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-3-amine?
The canonical SMILES for (3R)-1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-3-amine is N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1.
What is the InChIKey of (3R)-1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-3-amine?
The InChIKey is UIOGNJDOOMVHAP-GFCCVEGCSA-N. The full InChI is InChI=1S/C13H17F3N2/c14-13(15,16)11-4-1-3-10(7-11)8-18-6-2-5-12(17)9-18/h1,3-4,7,12H,2,5-6,8-9,17H2/t12-/m1/s1.
What are the key properties of (3R)-1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-3-amine?
(3R)-1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-3-amine has a molecular weight of 258.29 g/mol, XLogP of 2.63, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-3-amine is sourced from PubChem (CID 24904810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).