(3R,5S)-5-(hydroxymethyl)piperidin-3-ol

C6H13NO2 — CID 55287998

IUPAC(3R,5S)-5-(hydroxymethyl)piperidin-3-ol
SMILESOC[C@@H]1CNC[C@H](O)C1
InChIInChI=1S/C6H13NO2/c8-4-5-1-6(9)3-7-2-5/h5-9H,1-4H2/t5-,6+/m0/s1
InChIKeyXCPUOKRBVCHXNS-NTSWFWBYSA-N
MW131.18 g/mol
LogP-1.05
Rot. Bonds1

About (3R,5S)-5-(hydroxymethyl)piperidin-3-ol

(3R,5S)-5-(hydroxymethyl)piperidin-3-ol (PubChem CID 55287998) has the molecular formula C6H13NO2 and a molecular weight of 131.18 g/mol. Its IUPAC name is (3R,5S)-5-(hydroxymethyl)piperidin-3-ol.

Molecular Properties

Compound Name(3R,5S)-5-(hydroxymethyl)piperidin-3-ol
PubChem CID55287998
Molecular FormulaC6H13NO2
Molecular Weight131.18 g/mol
Exact Mass131.09
IUPAC Name(3R,5S)-5-(hydroxymethyl)piperidin-3-ol
SMILESOC[C@@H]1CNC[C@H](O)C1
InChIInChI=1S/C6H13NO2/c8-4-5-1-6(9)3-7-2-5/h5-9H,1-4H2/t5-,6+/m0/s1
InChIKeyXCPUOKRBVCHXNS-NTSWFWBYSA-N
XLogP-1.05
TPSA52.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.18
LogP ≤ 5-1.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze (3R,5S)-5-(hydroxymethyl)piperidin-3-ol 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

Afegostat
CID 447607
5-(Hydroxymethyl)piperidine-3,4-diol
CID 4452693
(2R/S,3S,4R,5R)-5-(Hydroxymethyl)piperidine-2,3,4-triol
CID 10197840
D-Galacto-Isofagomine
CID 10240946
(2r,3s,4r,5r)-5-(Hydroxymethyl)piperidine-2,3,4-Triol
CID 11987879
5-epi-Isofagomine
CID 10820691
(3S,4S,5S)-5-(Hydroxymethyl)piperidine-3,4-diol
CID 44578588
Piperidin-3-ylmethanol
CID 107308
(3R,4S,5R,6R)-5-(hydroxymethyl)-6-methylpiperidine-3,4-diol
CID 101735280
(S)-5-Methyl-piperidine-3,4-diol
CID 44319486
(3R,4R,5R)-5-(1-hydroxyethyl)piperidine-3,4-diol
CID 51356185
3-(Hydroxymethyl)piperidin-4-ol
CID 10419215

Frequently Asked Questions

What is the IUPAC name of (3R,5S)-5-(hydroxymethyl)piperidin-3-ol?
The IUPAC name of (3R,5S)-5-(hydroxymethyl)piperidin-3-ol (CID 55287998) is (3R,5S)-5-(hydroxymethyl)piperidin-3-ol.
What is the SMILES notation for (3R,5S)-5-(hydroxymethyl)piperidin-3-ol?
The canonical SMILES for (3R,5S)-5-(hydroxymethyl)piperidin-3-ol is OC[C@@H]1CNC[C@H](O)C1.
What is the InChIKey of (3R,5S)-5-(hydroxymethyl)piperidin-3-ol?
The InChIKey is XCPUOKRBVCHXNS-NTSWFWBYSA-N. The full InChI is InChI=1S/C6H13NO2/c8-4-5-1-6(9)3-7-2-5/h5-9H,1-4H2/t5-,6+/m0/s1.
What are the key properties of (3R,5S)-5-(hydroxymethyl)piperidin-3-ol?
(3R,5S)-5-(hydroxymethyl)piperidin-3-ol has a molecular weight of 131.18 g/mol, XLogP of -1.05, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,5S)-5-(hydroxymethyl)piperidin-3-ol is sourced from PubChem (CID 55287998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).