(2R)-2-(hydroxymethyl)pyrrolidin-3-ol

C5H11NO2 — CID 54340286

IUPAC(2R)-2-(hydroxymethyl)pyrrolidin-3-ol
SMILESOC[C@H]1NCCC1O
InChIInChI=1S/C5H11NO2/c7-3-4-5(8)1-2-6-4/h4-8H,1-3H2/t4-,5?/m1/s1
InChIKeyTYLFLHPQWQQWRD-CNZKWPKMSA-N
MW117.15 g/mol
LogP-1.30
Rot. Bonds1

About (2R)-2-(hydroxymethyl)pyrrolidin-3-ol

(2R)-2-(hydroxymethyl)pyrrolidin-3-ol (PubChem CID 54340286) has the molecular formula C5H11NO2 and a molecular weight of 117.15 g/mol. Its IUPAC name is (2R)-2-(hydroxymethyl)pyrrolidin-3-ol.

Molecular Properties

Compound Name(2R)-2-(hydroxymethyl)pyrrolidin-3-ol
PubChem CID54340286
Molecular FormulaC5H11NO2
Molecular Weight117.15 g/mol
Exact Mass117.08
IUPAC Name(2R)-2-(hydroxymethyl)pyrrolidin-3-ol
SMILESOC[C@H]1NCCC1O
InChIInChI=1S/C5H11NO2/c7-3-4-5(8)1-2-6-4/h4-8H,1-3H2/t4-,5?/m1/s1
InChIKeyTYLFLHPQWQQWRD-CNZKWPKMSA-N
XLogP-1.30
TPSA52.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.15
LogP ≤ 5-1.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(hydroxymethyl)pyrrolidin-3-ol?
The IUPAC name of (2R)-2-(hydroxymethyl)pyrrolidin-3-ol (CID 54340286) is (2R)-2-(hydroxymethyl)pyrrolidin-3-ol.
What is the SMILES notation for (2R)-2-(hydroxymethyl)pyrrolidin-3-ol?
The canonical SMILES for (2R)-2-(hydroxymethyl)pyrrolidin-3-ol is OC[C@H]1NCCC1O.
What is the InChIKey of (2R)-2-(hydroxymethyl)pyrrolidin-3-ol?
The InChIKey is TYLFLHPQWQQWRD-CNZKWPKMSA-N. The full InChI is InChI=1S/C5H11NO2/c7-3-4-5(8)1-2-6-4/h4-8H,1-3H2/t4-,5?/m1/s1.
What are the key properties of (2R)-2-(hydroxymethyl)pyrrolidin-3-ol?
(2R)-2-(hydroxymethyl)pyrrolidin-3-ol has a molecular weight of 117.15 g/mol, XLogP of -1.30, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(hydroxymethyl)pyrrolidin-3-ol is sourced from PubChem (CID 54340286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).