4-piperidin-4-ylsulfonylpyridine;hydrochloride

C10H15ClN2O2S — CID 71645560

IUPAC4-piperidin-4-ylsulfonylpyridine;hydrochloride
SMILESCl.O=S(=O)(c1ccncc1)C1CCNCC1
InChIInChI=1S/C10H14N2O2S.ClH/c13-15(14,9-1-5-11-6-2-9)10-3-7-12-8-4-10;/h1-2,5-6,10,12H,3-4,7-8H2;1H
InChIKeyFXPOGCWXMNLWOX-UHFFFAOYSA-N
MW262.76 g/mol
LogP1.03
Rot. Bonds2

About 4-piperidin-4-ylsulfonylpyridine;hydrochloride

4-piperidin-4-ylsulfonylpyridine;hydrochloride (PubChem CID 71645560) has the molecular formula C10H15ClN2O2S and a molecular weight of 262.76 g/mol. Its IUPAC name is 4-piperidin-4-ylsulfonylpyridine;hydrochloride.

Molecular Properties

Compound Name4-piperidin-4-ylsulfonylpyridine;hydrochloride
PubChem CID71645560
Molecular FormulaC10H15ClN2O2S
Molecular Weight262.76 g/mol
Exact Mass262.05
IUPAC Name4-piperidin-4-ylsulfonylpyridine;hydrochloride
SMILESCl.O=S(=O)(c1ccncc1)C1CCNCC1
InChIInChI=1S/C10H14N2O2S.ClH/c13-15(14,9-1-5-11-6-2-9)10-3-7-12-8-4-10;/h1-2,5-6,10,12H,3-4,7-8H2;1H
InChIKeyFXPOGCWXMNLWOX-UHFFFAOYSA-N
XLogP1.03
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.76
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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4-(4-ethoxyphenyl)sulfonylpiperidine;hydrochloride
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4-piperidin-4-ylsulfonyl-N-propan-2-ylaniline;dihydrochloride
CID 139989166
pyridine;4-(1H-pyrrol-2-ylsulfonyl)piperidine
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4-(4-ethoxyphenyl)sulfonylpiperidine
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3-bromo-2-piperidin-4-ylsulfonylpyridine;hydrochloride
CID 90320188
3-piperidin-4-ylsulfonylphenol
CID 84702713
3-methyl-6-piperidin-4-ylsulfonylpyridazine;hydrochloride
CID 71638724
(3R)-3-(4-methylphenyl)sulfonylpyrrolidine
CID 7016814
4-(1,3-benzodioxol-5-ylsulfonyl)piperidine
CID 82305550

Frequently Asked Questions

What is the IUPAC name of 4-piperidin-4-ylsulfonylpyridine;hydrochloride?
The IUPAC name of 4-piperidin-4-ylsulfonylpyridine;hydrochloride (CID 71645560) is 4-piperidin-4-ylsulfonylpyridine;hydrochloride.
What is the SMILES notation for 4-piperidin-4-ylsulfonylpyridine;hydrochloride?
The canonical SMILES for 4-piperidin-4-ylsulfonylpyridine;hydrochloride is Cl.O=S(=O)(c1ccncc1)C1CCNCC1.
What is the InChIKey of 4-piperidin-4-ylsulfonylpyridine;hydrochloride?
The InChIKey is FXPOGCWXMNLWOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2S.ClH/c13-15(14,9-1-5-11-6-2-9)10-3-7-12-8-4-10;/h1-2,5-6,10,12H,3-4,7-8H2;1H.
What are the key properties of 4-piperidin-4-ylsulfonylpyridine;hydrochloride?
4-piperidin-4-ylsulfonylpyridine;hydrochloride has a molecular weight of 262.76 g/mol, XLogP of 1.03, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-piperidin-4-ylsulfonylpyridine;hydrochloride is sourced from PubChem (CID 71645560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).