piperidine-2,3,4,5-tetrol;hydrochloride

C5H12ClNO4 — CID 45263220

IUPACpiperidine-2,3,4,5-tetrol;hydrochloride
SMILESCl.OC1CNC(O)C(O)C1O
InChIInChI=1S/C5H11NO4.ClH/c7-2-1-6-5(10)4(9)3(2)8;/h2-10H,1H2;1H
InChIKeyAEPDZTJJMIHYMG-UHFFFAOYSA-N
MW185.61 g/mol
LogP-2.59
Rot. Bonds

About piperidine-2,3,4,5-tetrol;hydrochloride

piperidine-2,3,4,5-tetrol;hydrochloride (PubChem CID 45263220) has the molecular formula C5H12ClNO4 and a molecular weight of 185.61 g/mol. Its IUPAC name is piperidine-2,3,4,5-tetrol;hydrochloride.

Molecular Properties

Compound Namepiperidine-2,3,4,5-tetrol;hydrochloride
PubChem CID45263220
Molecular FormulaC5H12ClNO4
Molecular Weight185.61 g/mol
Exact Mass185.05
IUPAC Namepiperidine-2,3,4,5-tetrol;hydrochloride
SMILESCl.OC1CNC(O)C(O)C1O
InChIInChI=1S/C5H11NO4.ClH/c7-2-1-6-5(10)4(9)3(2)8;/h2-10H,1H2;1H
InChIKeyAEPDZTJJMIHYMG-UHFFFAOYSA-N
XLogP-2.59
TPSA92.95 Ų
H-Bond Donors5
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.61
LogP ≤ 5-2.59
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 105

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Related Compounds

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(2R,3R,4S,5S)-2-methylpiperidine-3,4,5-triol
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(2S,3R,4S,5S)-2-methylpiperidine-3,4,5-triol
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(2R,4R)-2-(hydroxymethyl)piperidine-3,4,5-triol;(3S,4S)-2-(hydroxymethyl)piperidine-3,4,5-triol
CID 157357410
piperidine-3,4,5-triol;hydrochloride
CID 73223230
2-(hydroxymethyl)piperidine-3,4,5-triol;tungsten
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(2R,3S)-2-methylazetidin-3-ol;hydrochloride
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(2R,3S,4R,5S)-2-(2-hydroxyethyl)piperidine-3,4,5-triol
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Frequently Asked Questions

What is the IUPAC name of piperidine-2,3,4,5-tetrol;hydrochloride?
The IUPAC name of piperidine-2,3,4,5-tetrol;hydrochloride (CID 45263220) is piperidine-2,3,4,5-tetrol;hydrochloride.
What is the SMILES notation for piperidine-2,3,4,5-tetrol;hydrochloride?
The canonical SMILES for piperidine-2,3,4,5-tetrol;hydrochloride is Cl.OC1CNC(O)C(O)C1O.
What is the InChIKey of piperidine-2,3,4,5-tetrol;hydrochloride?
The InChIKey is AEPDZTJJMIHYMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO4.ClH/c7-2-1-6-5(10)4(9)3(2)8;/h2-10H,1H2;1H.
What are the key properties of piperidine-2,3,4,5-tetrol;hydrochloride?
piperidine-2,3,4,5-tetrol;hydrochloride has a molecular weight of 185.61 g/mol, XLogP of -2.59, 0 rotatable bonds, 5 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for piperidine-2,3,4,5-tetrol;hydrochloride is sourced from PubChem (CID 45263220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).