(R)-piperidin-4-yl-[4-(trifluoromethyl)phenyl]methanamine

C13H17F3N2 — CID 171314104

IUPAC(R)-piperidin-4-yl-[4-(trifluoromethyl)phenyl]methanamine
SMILESN[C@@H](c1ccc(C(F)(F)F)cc1)C1CCNCC1
InChIInChI=1S/C13H17F3N2/c14-13(15,16)11-3-1-9(2-4-11)12(17)10-5-7-18-8-6-10/h1-4,10,12,18H,5-8,17H2/t12-/m0/s1
InChIKeyJZUWWUQPVZIUFS-LBPRGKRZSA-N
MW258.29 g/mol
LogP2.70
Rot. Bonds2

About (R)-piperidin-4-yl-[4-(trifluoromethyl)phenyl]methanamine

(R)-piperidin-4-yl-[4-(trifluoromethyl)phenyl]methanamine (PubChem CID 171314104) has the molecular formula C13H17F3N2 and a molecular weight of 258.29 g/mol. Its IUPAC name is (R)-piperidin-4-yl-[4-(trifluoromethyl)phenyl]methanamine.

Molecular Properties

Compound Name(R)-piperidin-4-yl-[4-(trifluoromethyl)phenyl]methanamine
PubChem CID171314104
Molecular FormulaC13H17F3N2
Molecular Weight258.29 g/mol
Exact Mass258.13
IUPAC Name(R)-piperidin-4-yl-[4-(trifluoromethyl)phenyl]methanamine
SMILESN[C@@H](c1ccc(C(F)(F)F)cc1)C1CCNCC1
InChIInChI=1S/C13H17F3N2/c14-13(15,16)11-3-1-9(2-4-11)12(17)10-5-7-18-8-6-10/h1-4,10,12,18H,5-8,17H2/t12-/m0/s1
InChIKeyJZUWWUQPVZIUFS-LBPRGKRZSA-N
XLogP2.70
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.29
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(R)-piperidin-4-yl-[4-(trifluoromethylsulfanyl)phenyl]methanamine
CID 171314433
(R)-cyclopentyl-[4-[4-(trifluoromethyl)phenyl]phenyl]methanamine;hydrochloride
CID 171211545
4-[(S)-phenyl-[4-(trifluoromethyl)phenyl]methyl]piperidine
CID 124514391
(R)-[3-bromo-5-(trifluoromethyl)phenyl]-piperidin-4-ylmethanamine
CID 171314429
(4-chlorophenyl)-piperidin-4-ylmethanamine;dihydrochloride
CID 24829096
(3,4-difluorophenyl)-piperidin-4-ylmethanamine
CID 82287810
(R)-[2-methoxy-4-(trifluoromethyl)phenyl]-piperidin-4-ylmethanamine;hydrochloride
CID 171314755
4-[1-fluoro-2-[4-(trifluoromethyl)phenyl]ethyl]piperidine
CID 112563753
piperidin-4-yl-[3-(trifluoromethyl)phenyl]methanol
CID 11392289
(R)-(4-fluoro-3-methylphenyl)-piperidin-4-ylmethanamine;hydrochloride
CID 171314319
(R)-(6-chloro-3-pyridinyl)-piperidin-4-ylmethanamine;hydrochloride
CID 171314290
(R)-(3,4-dichlorophenyl)-piperidin-4-ylmethanamine;hydrochloride
CID 171314201

Frequently Asked Questions

What is the IUPAC name of (R)-piperidin-4-yl-[4-(trifluoromethyl)phenyl]methanamine?
The IUPAC name of (R)-piperidin-4-yl-[4-(trifluoromethyl)phenyl]methanamine (CID 171314104) is (R)-piperidin-4-yl-[4-(trifluoromethyl)phenyl]methanamine.
What is the SMILES notation for (R)-piperidin-4-yl-[4-(trifluoromethyl)phenyl]methanamine?
The canonical SMILES for (R)-piperidin-4-yl-[4-(trifluoromethyl)phenyl]methanamine is N[C@@H](c1ccc(C(F)(F)F)cc1)C1CCNCC1.
What is the InChIKey of (R)-piperidin-4-yl-[4-(trifluoromethyl)phenyl]methanamine?
The InChIKey is JZUWWUQPVZIUFS-LBPRGKRZSA-N. The full InChI is InChI=1S/C13H17F3N2/c14-13(15,16)11-3-1-9(2-4-11)12(17)10-5-7-18-8-6-10/h1-4,10,12,18H,5-8,17H2/t12-/m0/s1.
What are the key properties of (R)-piperidin-4-yl-[4-(trifluoromethyl)phenyl]methanamine?
(R)-piperidin-4-yl-[4-(trifluoromethyl)phenyl]methanamine has a molecular weight of 258.29 g/mol, XLogP of 2.70, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-piperidin-4-yl-[4-(trifluoromethyl)phenyl]methanamine is sourced from PubChem (CID 171314104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).