5-methyl-2-[(R)-[(3S)-piperidin-3-yl]sulfinyl]pyridine

C11H16N2OS — CID 97162908

IUPAC5-methyl-2-[(R)-[(3S)-piperidin-3-yl]sulfinyl]pyridine
SMILESCc1ccc([S@](=O)[C@H]2CCCNC2)nc1
InChIInChI=1S/C11H16N2OS/c1-9-4-5-11(13-7-9)15(14)10-3-2-6-12-8-10/h4-5,7,10,12H,2-3,6,8H2,1H3/t10-,15+/m0/s1
InChIKeyMTKNDDTUDNCKPO-ZUZCIYMTSA-N
MW224.33 g/mol
LogP1.25
Rot. Bonds2

About 5-methyl-2-[(R)-[(3S)-piperidin-3-yl]sulfinyl]pyridine

5-methyl-2-[(R)-[(3S)-piperidin-3-yl]sulfinyl]pyridine (PubChem CID 97162908) has the molecular formula C11H16N2OS and a molecular weight of 224.33 g/mol. Its IUPAC name is 5-methyl-2-[(R)-[(3S)-piperidin-3-yl]sulfinyl]pyridine.

Molecular Properties

Compound Name5-methyl-2-[(R)-[(3S)-piperidin-3-yl]sulfinyl]pyridine
PubChem CID97162908
Molecular FormulaC11H16N2OS
Molecular Weight224.33 g/mol
Exact Mass224.10
IUPAC Name5-methyl-2-[(R)-[(3S)-piperidin-3-yl]sulfinyl]pyridine
SMILESCc1ccc([S@](=O)[C@H]2CCCNC2)nc1
InChIInChI=1S/C11H16N2OS/c1-9-4-5-11(13-7-9)15(14)10-3-2-6-12-8-10/h4-5,7,10,12H,2-3,6,8H2,1H3/t10-,15+/m0/s1
InChIKeyMTKNDDTUDNCKPO-ZUZCIYMTSA-N
XLogP1.25
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.33
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-methyl-2-[(R)-[(3S)-piperidin-3-yl]sulfinyl]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

5-methyl-2-[(3R)-pyrrolidin-3-yl]sulfinylpyridine
CID 71638683
2-piperidin-3-ylsulfinylpyridine;hydrochloride
CID 71645974
2-chloro-4-[(S)-[(3R)-piperidin-3-yl]sulfinyl]pyrimidine
CID 97163773
2-piperidin-3-ylsulfinylpyrazine;hydrochloride
CID 71645980
2-[(S)-[(3S)-piperidin-3-yl]sulfinyl]quinoxaline
CID 97166109
4-methyl-2-piperidin-3-ylsulfinylpyrimidine
CID 71638991
5-methyl-2-[(R)-piperidin-4-ylmethylsulfinyl]pyridine
CID 97162928
2-[(S)-[(3S)-piperidin-3-yl]sulfinyl]pyrimidine
CID 97166117
4-[(S)-[(3R)-piperidin-3-yl]sulfinyl]pyridine
CID 97166103
3-methyl-6-[(R)-[(3S)-pyrrolidin-3-yl]sulfinyl]pyridazine;hydrochloride
CID 170987729
2-[(3R)-pyrrolidin-3-yl]sulfinylpyridine;hydrochloride
CID 71645428
5-methyl-2-[(3S)-piperidin-3-yl]oxypyridine
CID 66246612

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-[(R)-[(3S)-piperidin-3-yl]sulfinyl]pyridine?
The IUPAC name of 5-methyl-2-[(R)-[(3S)-piperidin-3-yl]sulfinyl]pyridine (CID 97162908) is 5-methyl-2-[(R)-[(3S)-piperidin-3-yl]sulfinyl]pyridine.
What is the SMILES notation for 5-methyl-2-[(R)-[(3S)-piperidin-3-yl]sulfinyl]pyridine?
The canonical SMILES for 5-methyl-2-[(R)-[(3S)-piperidin-3-yl]sulfinyl]pyridine is Cc1ccc([S@](=O)[C@H]2CCCNC2)nc1.
What is the InChIKey of 5-methyl-2-[(R)-[(3S)-piperidin-3-yl]sulfinyl]pyridine?
The InChIKey is MTKNDDTUDNCKPO-ZUZCIYMTSA-N. The full InChI is InChI=1S/C11H16N2OS/c1-9-4-5-11(13-7-9)15(14)10-3-2-6-12-8-10/h4-5,7,10,12H,2-3,6,8H2,1H3/t10-,15+/m0/s1.
What are the key properties of 5-methyl-2-[(R)-[(3S)-piperidin-3-yl]sulfinyl]pyridine?
5-methyl-2-[(R)-[(3S)-piperidin-3-yl]sulfinyl]pyridine has a molecular weight of 224.33 g/mol, XLogP of 1.25, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-[(R)-[(3S)-piperidin-3-yl]sulfinyl]pyridine is sourced from PubChem (CID 97162908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).