3-[(2S)-piperidin-2-yl]-5-(trifluoromethyl)pyridine

C11H13F3N2 — CID 131397807

IUPAC3-[(2S)-piperidin-2-yl]-5-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1cncc([C@@H]2CCCCN2)c1
InChIInChI=1S/C11H13F3N2/c12-11(13,14)9-5-8(6-15-7-9)10-3-1-2-4-16-10/h5-7,10,16H,1-4H2/t10-/m0/s1
InChIKeyNAIOLQPQSIFPPW-JTQLQIEISA-N
MW230.23 g/mol
LogP2.91
Rot. Bonds1

About 3-[(2S)-piperidin-2-yl]-5-(trifluoromethyl)pyridine

3-[(2S)-piperidin-2-yl]-5-(trifluoromethyl)pyridine (PubChem CID 131397807) has the molecular formula C11H13F3N2 and a molecular weight of 230.23 g/mol. Its IUPAC name is 3-[(2S)-piperidin-2-yl]-5-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name3-[(2S)-piperidin-2-yl]-5-(trifluoromethyl)pyridine
PubChem CID131397807
Molecular FormulaC11H13F3N2
Molecular Weight230.23 g/mol
Exact Mass230.10
IUPAC Name3-[(2S)-piperidin-2-yl]-5-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1cncc([C@@H]2CCCCN2)c1
InChIInChI=1S/C11H13F3N2/c12-11(13,14)9-5-8(6-15-7-9)10-3-1-2-4-16-10/h5-7,10,16H,1-4H2/t10-/m0/s1
InChIKeyNAIOLQPQSIFPPW-JTQLQIEISA-N
XLogP2.91
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.23
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-[(2S)-piperidin-2-yl]-5-(trifluoromethyl)pyridine 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

3-methyl-5-[(2R)-piperidin-2-yl]pyridine
CID 96741558
3-bromo-5-piperidin-2-ylpyridine;dihydrochloride
CID 122198515
2-[4-(trifluoromethyl)phenyl]azepane
CID 3972899
3-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine
CID 71250619
5-[(2S)-pyrrolidin-2-yl]pyridin-3-ol
CID 55276544
3-(4-fluorophenoxy)-5-piperidin-2-ylpyridine
CID 143912807
3-bromo-5-pyrrolidin-2-ylpyridine;dihydrochloride
CID 155487206
3-chloro-5-pyrrolidin-2-ylpyridine;dihydrochloride
CID 154733314
2-[3-(2-fluoropropan-2-yl)phenyl]piperidine
CID 84687033
3-methoxy-5-[(2R)-pyrrolidin-2-yl]pyridine
CID 130624742
5-pyrrolidin-2-ylpyridine-3-carbaldehyde
CID 123459636
[5-[(2S)-pyrrolidin-2-yl]-3-pyridinyl]boronic acid
CID 124671778

Frequently Asked Questions

What is the IUPAC name of 3-[(2S)-piperidin-2-yl]-5-(trifluoromethyl)pyridine?
The IUPAC name of 3-[(2S)-piperidin-2-yl]-5-(trifluoromethyl)pyridine (CID 131397807) is 3-[(2S)-piperidin-2-yl]-5-(trifluoromethyl)pyridine.
What is the SMILES notation for 3-[(2S)-piperidin-2-yl]-5-(trifluoromethyl)pyridine?
The canonical SMILES for 3-[(2S)-piperidin-2-yl]-5-(trifluoromethyl)pyridine is FC(F)(F)c1cncc([C@@H]2CCCCN2)c1.
What is the InChIKey of 3-[(2S)-piperidin-2-yl]-5-(trifluoromethyl)pyridine?
The InChIKey is NAIOLQPQSIFPPW-JTQLQIEISA-N. The full InChI is InChI=1S/C11H13F3N2/c12-11(13,14)9-5-8(6-15-7-9)10-3-1-2-4-16-10/h5-7,10,16H,1-4H2/t10-/m0/s1.
What are the key properties of 3-[(2S)-piperidin-2-yl]-5-(trifluoromethyl)pyridine?
3-[(2S)-piperidin-2-yl]-5-(trifluoromethyl)pyridine has a molecular weight of 230.23 g/mol, XLogP of 2.91, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2S)-piperidin-2-yl]-5-(trifluoromethyl)pyridine is sourced from PubChem (CID 131397807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).