2-[(R)-[(2R)-piperidin-2-yl]methylsulfinyl]pyridine

C11H16N2OS — CID 97166204

IUPAC2-[(R)-[(2R)-piperidin-2-yl]methylsulfinyl]pyridine
SMILESO=[S@](C[C@H]1CCCCN1)c1ccccn1
InChIInChI=1S/C11H16N2OS/c14-15(11-6-2-4-8-13-11)9-10-5-1-3-7-12-10/h2,4,6,8,10,12H,1,3,5,7,9H2/t10-,15-/m1/s1
InChIKeyMQNFEMSMFFVWAJ-MEBBXXQBSA-N
MW224.33 g/mol
LogP1.33
Rot. Bonds3

About 2-[(R)-[(2R)-piperidin-2-yl]methylsulfinyl]pyridine

2-[(R)-[(2R)-piperidin-2-yl]methylsulfinyl]pyridine (PubChem CID 97166204) has the molecular formula C11H16N2OS and a molecular weight of 224.33 g/mol. Its IUPAC name is 2-[(R)-[(2R)-piperidin-2-yl]methylsulfinyl]pyridine.

Molecular Properties

Compound Name2-[(R)-[(2R)-piperidin-2-yl]methylsulfinyl]pyridine
PubChem CID97166204
Molecular FormulaC11H16N2OS
Molecular Weight224.33 g/mol
Exact Mass224.10
IUPAC Name2-[(R)-[(2R)-piperidin-2-yl]methylsulfinyl]pyridine
SMILESO=[S@](C[C@H]1CCCCN1)c1ccccn1
InChIInChI=1S/C11H16N2OS/c14-15(11-6-2-4-8-13-11)9-10-5-1-3-7-12-10/h2,4,6,8,10,12H,1,3,5,7,9H2/t10-,15-/m1/s1
InChIKeyMQNFEMSMFFVWAJ-MEBBXXQBSA-N
XLogP1.33
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.33
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(piperidin-2-ylmethylsulfinyl)pyridine;hydrochloride
CID 71646077
2-[[(R)-[(2R)-piperidin-2-yl]methylsulfinyl]methyl]pyridine
CID 97166240
2-[(R)-[(2R)-piperidin-2-yl]methylsulfinyl]quinoxaline
CID 97166212
2-bromo-6-[(R)-[(2R)-piperidin-2-yl]methylsulfinyl]pyridine
CID 97178213
2-(piperidin-2-ylmethylsulfinylmethyl)pyridine;hydrochloride
CID 71646095
2-(cyclopropylmethylsulfinyl)pyridine
CID 66803349
2-(piperidin-4-ylmethylsulfinyl)pyridine;hydrochloride
CID 71646197
2-bromo-6-(pyrrolidin-2-ylmethylsulfinyl)pyridine
CID 71636432
2-(pyrrolidin-2-ylmethylsulfinyl)pyridine-4-carbonitrile
CID 71646106
2-bromo-6-(pyrrolidin-2-ylmethylsulfinyl)pyridine;hydrochloride
CID 71636431
2-chloro-4-[(S)-[(2R)-pyrrolidin-2-yl]methylsulfinyl]pyrimidine
CID 97163785
2-piperidin-2-yl-1-pyridin-2-ylethanone
CID 79539171

Frequently Asked Questions

What is the IUPAC name of 2-[(R)-[(2R)-piperidin-2-yl]methylsulfinyl]pyridine?
The IUPAC name of 2-[(R)-[(2R)-piperidin-2-yl]methylsulfinyl]pyridine (CID 97166204) is 2-[(R)-[(2R)-piperidin-2-yl]methylsulfinyl]pyridine.
What is the SMILES notation for 2-[(R)-[(2R)-piperidin-2-yl]methylsulfinyl]pyridine?
The canonical SMILES for 2-[(R)-[(2R)-piperidin-2-yl]methylsulfinyl]pyridine is O=[S@](C[C@H]1CCCCN1)c1ccccn1.
What is the InChIKey of 2-[(R)-[(2R)-piperidin-2-yl]methylsulfinyl]pyridine?
The InChIKey is MQNFEMSMFFVWAJ-MEBBXXQBSA-N. The full InChI is InChI=1S/C11H16N2OS/c14-15(11-6-2-4-8-13-11)9-10-5-1-3-7-12-10/h2,4,6,8,10,12H,1,3,5,7,9H2/t10-,15-/m1/s1.
What are the key properties of 2-[(R)-[(2R)-piperidin-2-yl]methylsulfinyl]pyridine?
2-[(R)-[(2R)-piperidin-2-yl]methylsulfinyl]pyridine has a molecular weight of 224.33 g/mol, XLogP of 1.33, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(R)-[(2R)-piperidin-2-yl]methylsulfinyl]pyridine is sourced from PubChem (CID 97166204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).