(3R,5R)-piperidine-3,4,5-triol

C5H11NO3 — CID 10464382

IUPAC(3R,5R)-piperidine-3,4,5-triol
SMILESOC1[C@H](O)CNC[C@H]1O
InChIInChI=1S/C5H11NO3/c7-3-1-6-2-4(8)5(3)9/h3-9H,1-2H2/t3-,4-/m1/s1
InChIKeyRMCNETIHECSPMZ-QWWZWVQMSA-N
MW133.15 g/mol
LogP-2.33
Rot. Bonds

About (3R,5R)-piperidine-3,4,5-triol

(3R,5R)-piperidine-3,4,5-triol (PubChem CID 10464382) has the molecular formula C5H11NO3 and a molecular weight of 133.15 g/mol. Its IUPAC name is (3R,5R)-piperidine-3,4,5-triol.

Molecular Properties

Compound Name(3R,5R)-piperidine-3,4,5-triol
PubChem CID10464382
Molecular FormulaC5H11NO3
Molecular Weight133.15 g/mol
Exact Mass133.07
IUPAC Name(3R,5R)-piperidine-3,4,5-triol
SMILESOC1[C@H](O)CNC[C@H]1O
InChIInChI=1S/C5H11NO3/c7-3-1-6-2-4(8)5(3)9/h3-9H,1-2H2/t3-,4-/m1/s1
InChIKeyRMCNETIHECSPMZ-QWWZWVQMSA-N
XLogP-2.33
TPSA72.72 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.15
LogP ≤ 5-2.33
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (3R,5R)-piperidine-3,4,5-triol?
The IUPAC name of (3R,5R)-piperidine-3,4,5-triol (CID 10464382) is (3R,5R)-piperidine-3,4,5-triol.
What is the SMILES notation for (3R,5R)-piperidine-3,4,5-triol?
The canonical SMILES for (3R,5R)-piperidine-3,4,5-triol is OC1[C@H](O)CNC[C@H]1O.
What is the InChIKey of (3R,5R)-piperidine-3,4,5-triol?
The InChIKey is RMCNETIHECSPMZ-QWWZWVQMSA-N. The full InChI is InChI=1S/C5H11NO3/c7-3-1-6-2-4(8)5(3)9/h3-9H,1-2H2/t3-,4-/m1/s1.
What are the key properties of (3R,5R)-piperidine-3,4,5-triol?
(3R,5R)-piperidine-3,4,5-triol has a molecular weight of 133.15 g/mol, XLogP of -2.33, 0 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,5R)-piperidine-3,4,5-triol is sourced from PubChem (CID 10464382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).