(R)-[3-chloro-4-(trifluoromethyl)phenyl]-cyclopentylmethanamine

C13H15ClF3N — CID 171215256

IUPAC(R)-[3-chloro-4-(trifluoromethyl)phenyl]-cyclopentylmethanamine
SMILESN[C@@H](c1ccc(C(F)(F)F)c(Cl)c1)C1CCCC1
InChIInChI=1S/C13H15ClF3N/c14-11-7-9(5-6-10(11)13(15,16)17)12(18)8-3-1-2-4-8/h5-8,12H,1-4,18H2/t12-/m1/s1
InChIKeyCXLHBGJPULNKQA-GFCCVEGCSA-N
MW277.72 g/mol
LogP4.55
Rot. Bonds2

About (R)-[3-chloro-4-(trifluoromethyl)phenyl]-cyclopentylmethanamine

(R)-[3-chloro-4-(trifluoromethyl)phenyl]-cyclopentylmethanamine (PubChem CID 171215256) has the molecular formula C13H15ClF3N and a molecular weight of 277.72 g/mol. Its IUPAC name is (R)-[3-chloro-4-(trifluoromethyl)phenyl]-cyclopentylmethanamine.

Molecular Properties

Compound Name(R)-[3-chloro-4-(trifluoromethyl)phenyl]-cyclopentylmethanamine
PubChem CID171215256
Molecular FormulaC13H15ClF3N
Molecular Weight277.72 g/mol
Exact Mass277.08
IUPAC Name(R)-[3-chloro-4-(trifluoromethyl)phenyl]-cyclopentylmethanamine
SMILESN[C@@H](c1ccc(C(F)(F)F)c(Cl)c1)C1CCCC1
InChIInChI=1S/C13H15ClF3N/c14-11-7-9(5-6-10(11)13(15,16)17)12(18)8-3-1-2-4-8/h5-8,12H,1-4,18H2/t12-/m1/s1
InChIKeyCXLHBGJPULNKQA-GFCCVEGCSA-N
XLogP4.55
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.72
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (R)-[3-chloro-4-(trifluoromethyl)phenyl]-cyclopentylmethanamine 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

(R)-[4-chloro-3-(trifluoromethyl)phenyl]-cyclobutylmethanamine;hydrochloride
CID 171207653
(1R,2S)-2-amino-2-[3-chloro-4-(trifluoromethyl)phenyl]-1-cyclobutylethanol
CID 171271379
(1S,2R)-2-amino-2-[3-chloro-4-(trifluoromethyl)phenyl]-1-cyclobutylethanol;hydrochloride
CID 171265706
(S)-cyclopentyl-[4-fluoro-3-(trifluoromethyl)phenyl]methanamine
CID 171222169
cycloheptyl-[4-fluoro-3-(trifluoromethyl)phenyl]methanamine
CID 105027734
(3-chloro-4-fluorophenyl)-cyclohexylmethanamine
CID 63093302
(S)-(3-chloro-4-methylphenyl)-cyclopentylmethanamine
CID 131581688
(S)-(3-chloro-4-methylphenyl)-cyclohexylmethanamine
CID 171224008
(S)-[2-chloro-6-(trifluoromethyl)phenyl]-cyclohexylmethanamine
CID 171227177
(R)-(3-chloro-4-methylphenyl)-cyclohexylmethanamine;hydrochloride
CID 171204433
(S)-[4-chloro-2-(trifluoromethyl)phenyl]-cyclopentylmethanamine
CID 171227119
(1S)-1-[3-chloro-4-(trifluoromethyl)phenyl]-2,2,2-trifluoroethanamine
CID 66512002

Frequently Asked Questions

What is the IUPAC name of (R)-[3-chloro-4-(trifluoromethyl)phenyl]-cyclopentylmethanamine?
The IUPAC name of (R)-[3-chloro-4-(trifluoromethyl)phenyl]-cyclopentylmethanamine (CID 171215256) is (R)-[3-chloro-4-(trifluoromethyl)phenyl]-cyclopentylmethanamine.
What is the SMILES notation for (R)-[3-chloro-4-(trifluoromethyl)phenyl]-cyclopentylmethanamine?
The canonical SMILES for (R)-[3-chloro-4-(trifluoromethyl)phenyl]-cyclopentylmethanamine is N[C@@H](c1ccc(C(F)(F)F)c(Cl)c1)C1CCCC1.
What is the InChIKey of (R)-[3-chloro-4-(trifluoromethyl)phenyl]-cyclopentylmethanamine?
The InChIKey is CXLHBGJPULNKQA-GFCCVEGCSA-N. The full InChI is InChI=1S/C13H15ClF3N/c14-11-7-9(5-6-10(11)13(15,16)17)12(18)8-3-1-2-4-8/h5-8,12H,1-4,18H2/t12-/m1/s1.
What are the key properties of (R)-[3-chloro-4-(trifluoromethyl)phenyl]-cyclopentylmethanamine?
(R)-[3-chloro-4-(trifluoromethyl)phenyl]-cyclopentylmethanamine has a molecular weight of 277.72 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 (R)-[3-chloro-4-(trifluoromethyl)phenyl]-cyclopentylmethanamine is sourced from PubChem (CID 171215256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).