(R)-piperidin-4-yl-(2,4,6-trifluorophenyl)methanamine;hydrochloride

C12H16ClF3N2 — CID 171314352

IUPAC(R)-piperidin-4-yl-(2,4,6-trifluorophenyl)methanamine;hydrochloride
SMILESCl.N[C@@H](c1c(F)cc(F)cc1F)C1CCNCC1
InChIInChI=1S/C12H15F3N2.ClH/c13-8-5-9(14)11(10(15)6-8)12(16)7-1-3-17-4-2-7;/h5-7,12,17H,1-4,16H2;1H/t12-;/m1./s1
InChIKeySQVFKWODZORFFE-UTONKHPSSA-N
MW280.72 g/mol
LogP2.53
Rot. Bonds2

About (R)-piperidin-4-yl-(2,4,6-trifluorophenyl)methanamine;hydrochloride

(R)-piperidin-4-yl-(2,4,6-trifluorophenyl)methanamine;hydrochloride (PubChem CID 171314352) has the molecular formula C12H16ClF3N2 and a molecular weight of 280.72 g/mol. Its IUPAC name is (R)-piperidin-4-yl-(2,4,6-trifluorophenyl)methanamine;hydrochloride.

Molecular Properties

Compound Name(R)-piperidin-4-yl-(2,4,6-trifluorophenyl)methanamine;hydrochloride
PubChem CID171314352
Molecular FormulaC12H16ClF3N2
Molecular Weight280.72 g/mol
Exact Mass280.10
IUPAC Name(R)-piperidin-4-yl-(2,4,6-trifluorophenyl)methanamine;hydrochloride
SMILESCl.N[C@@H](c1c(F)cc(F)cc1F)C1CCNCC1
InChIInChI=1S/C12H15F3N2.ClH/c13-8-5-9(14)11(10(15)6-8)12(16)7-1-3-17-4-2-7;/h5-7,12,17H,1-4,16H2;1H/t12-;/m1./s1
InChIKeySQVFKWODZORFFE-UTONKHPSSA-N
XLogP2.53
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.72
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (R)-piperidin-4-yl-(2,4,6-trifluorophenyl)methanamine;hydrochloride 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

(S)-cyclohexyl-(2,4,6-trifluorophenyl)methanamine
CID 28501633
(R)-(2,5-difluorophenyl)-piperidin-4-ylmethanamine;hydrochloride
CID 171314322
(2,5-difluorophenyl)-piperidin-4-ylmethanamine
CID 82287809
(R)-(2-bromo-6-fluorophenyl)-piperidin-4-ylmethanamine;hydrochloride
CID 171314298
(S)-(4-chloro-2,6-difluorophenyl)-cyclopropylmethanamine;hydrochloride
CID 171230540
(S)-(4-bromo-2,6-difluorophenyl)-cyclopropylmethanamine;hydrochloride
CID 171226288
(3,4-difluorophenyl)-piperidin-4-ylmethanamine
CID 82287810
(R)-(4-fluoro-2-methylphenyl)-piperidin-4-ylmethanamine;hydrochloride
CID 171314219
(R)-(4-fluoro-3-methylphenyl)-piperidin-4-ylmethanamine;hydrochloride
CID 171314319
(R)-(4-bromo-2,6-difluorophenyl)-cyclohexylmethanamine;hydrochloride
CID 171206717
(S)-(4-chloro-2,6-difluorophenyl)-cyclopentylmethanamine
CID 131484031
(R)-(2-bromo-4-fluorophenyl)-piperidin-4-ylmethanamine
CID 171314194

Frequently Asked Questions

What is the IUPAC name of (R)-piperidin-4-yl-(2,4,6-trifluorophenyl)methanamine;hydrochloride?
The IUPAC name of (R)-piperidin-4-yl-(2,4,6-trifluorophenyl)methanamine;hydrochloride (CID 171314352) is (R)-piperidin-4-yl-(2,4,6-trifluorophenyl)methanamine;hydrochloride.
What is the SMILES notation for (R)-piperidin-4-yl-(2,4,6-trifluorophenyl)methanamine;hydrochloride?
The canonical SMILES for (R)-piperidin-4-yl-(2,4,6-trifluorophenyl)methanamine;hydrochloride is Cl.N[C@@H](c1c(F)cc(F)cc1F)C1CCNCC1.
What is the InChIKey of (R)-piperidin-4-yl-(2,4,6-trifluorophenyl)methanamine;hydrochloride?
The InChIKey is SQVFKWODZORFFE-UTONKHPSSA-N. The full InChI is InChI=1S/C12H15F3N2.ClH/c13-8-5-9(14)11(10(15)6-8)12(16)7-1-3-17-4-2-7;/h5-7,12,17H,1-4,16H2;1H/t12-;/m1./s1.
What are the key properties of (R)-piperidin-4-yl-(2,4,6-trifluorophenyl)methanamine;hydrochloride?
(R)-piperidin-4-yl-(2,4,6-trifluorophenyl)methanamine;hydrochloride has a molecular weight of 280.72 g/mol, XLogP of 2.53, 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-(2,4,6-trifluorophenyl)methanamine;hydrochloride is sourced from PubChem (CID 171314352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).