2-[3-(trifluoromethyl)phenyl]piperidin-4-amine

C12H15F3N2 — CID 117000351

IUPAC2-[3-(trifluoromethyl)phenyl]piperidin-4-amine
SMILESNC1CCNC(c2cccc(C(F)(F)F)c2)C1
InChIInChI=1S/C12H15F3N2/c13-12(14,15)9-3-1-2-8(6-9)11-7-10(16)4-5-17-11/h1-3,6,10-11,17H,4-5,7,16H2
InChIKeyQUZCIKJIXHYNFU-UHFFFAOYSA-N
MW244.26 g/mol
LogP2.46
Rot. Bonds1

About 2-[3-(trifluoromethyl)phenyl]piperidin-4-amine

2-[3-(trifluoromethyl)phenyl]piperidin-4-amine (PubChem CID 117000351) has the molecular formula C12H15F3N2 and a molecular weight of 244.26 g/mol. Its IUPAC name is 2-[3-(trifluoromethyl)phenyl]piperidin-4-amine.

Molecular Properties

Compound Name2-[3-(trifluoromethyl)phenyl]piperidin-4-amine
PubChem CID117000351
Molecular FormulaC12H15F3N2
Molecular Weight244.26 g/mol
Exact Mass244.12
IUPAC Name2-[3-(trifluoromethyl)phenyl]piperidin-4-amine
SMILESNC1CCNC(c2cccc(C(F)(F)F)c2)C1
InChIInChI=1S/C12H15F3N2/c13-12(14,15)9-3-1-2-8(6-9)11-7-10(16)4-5-17-11/h1-3,6,10-11,17H,4-5,7,16H2
InChIKeyQUZCIKJIXHYNFU-UHFFFAOYSA-N
XLogP2.46
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.26
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-[3-(trifluoromethyl)phenyl]piperidin-4-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

Fenfluramine
CID 3337
Dexfenfluramine
CID 66265
(+)-Fenfluramine hydrochloride
CID 66264
Fenfluramine Hydrochloride
CID 91452
1-(Bis(4-fluorophenyl)methyl)piperazine
CID 152932
1-(3-Fluorobenzyl)piperazine
CID 903813
Levofenfluramine
CID 65801
2-Benzylpiperidine
CID 118004
1-(4-Fluorobenzyl)piperazine
CID 796563
1-Benzyl-4-piperidylamine
CID 415852
1-Methyl-3-phenylpiperazine
CID 2760009
1-[4-(Trifluoromethyl)benzyl]piperazine
CID 2782803

Frequently Asked Questions

What is the IUPAC name of 2-[3-(trifluoromethyl)phenyl]piperidin-4-amine?
The IUPAC name of 2-[3-(trifluoromethyl)phenyl]piperidin-4-amine (CID 117000351) is 2-[3-(trifluoromethyl)phenyl]piperidin-4-amine.
What is the SMILES notation for 2-[3-(trifluoromethyl)phenyl]piperidin-4-amine?
The canonical SMILES for 2-[3-(trifluoromethyl)phenyl]piperidin-4-amine is NC1CCNC(c2cccc(C(F)(F)F)c2)C1.
What is the InChIKey of 2-[3-(trifluoromethyl)phenyl]piperidin-4-amine?
The InChIKey is QUZCIKJIXHYNFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15F3N2/c13-12(14,15)9-3-1-2-8(6-9)11-7-10(16)4-5-17-11/h1-3,6,10-11,17H,4-5,7,16H2.
What are the key properties of 2-[3-(trifluoromethyl)phenyl]piperidin-4-amine?
2-[3-(trifluoromethyl)phenyl]piperidin-4-amine has a molecular weight of 244.26 g/mol, XLogP of 2.46, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(trifluoromethyl)phenyl]piperidin-4-amine is sourced from PubChem (CID 117000351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).