[2-(hydroxymethyl)pyrrolidin-2-yl]methanol

C6H13NO2 — CID 55287598

IUPAC[2-(hydroxymethyl)pyrrolidin-2-yl]methanol
SMILESOCC1(CO)CCCN1
InChIInChI=1S/C6H13NO2/c8-4-6(5-9)2-1-3-7-6/h7-9H,1-5H2
InChIKeyGOPWQGFZLNLOLI-UHFFFAOYSA-N
MW131.18 g/mol
LogP-0.91
Rot. Bonds2

About [2-(hydroxymethyl)pyrrolidin-2-yl]methanol

[2-(hydroxymethyl)pyrrolidin-2-yl]methanol (PubChem CID 55287598) has the molecular formula C6H13NO2 and a molecular weight of 131.18 g/mol. Its IUPAC name is [2-(hydroxymethyl)pyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[2-(hydroxymethyl)pyrrolidin-2-yl]methanol
PubChem CID55287598
Molecular FormulaC6H13NO2
Molecular Weight131.18 g/mol
Exact Mass131.09
IUPAC Name[2-(hydroxymethyl)pyrrolidin-2-yl]methanol
SMILESOCC1(CO)CCCN1
InChIInChI=1S/C6H13NO2/c8-4-6(5-9)2-1-3-7-6/h7-9H,1-5H2
InChIKeyGOPWQGFZLNLOLI-UHFFFAOYSA-N
XLogP-0.91
TPSA52.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.18
LogP ≤ 5-0.91
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-(hydroxymethyl)pyrrolidin-2-yl]methanol?
The IUPAC name of [2-(hydroxymethyl)pyrrolidin-2-yl]methanol (CID 55287598) is [2-(hydroxymethyl)pyrrolidin-2-yl]methanol.
What is the SMILES notation for [2-(hydroxymethyl)pyrrolidin-2-yl]methanol?
The canonical SMILES for [2-(hydroxymethyl)pyrrolidin-2-yl]methanol is OCC1(CO)CCCN1.
What is the InChIKey of [2-(hydroxymethyl)pyrrolidin-2-yl]methanol?
The InChIKey is GOPWQGFZLNLOLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO2/c8-4-6(5-9)2-1-3-7-6/h7-9H,1-5H2.
What are the key properties of [2-(hydroxymethyl)pyrrolidin-2-yl]methanol?
[2-(hydroxymethyl)pyrrolidin-2-yl]methanol has a molecular weight of 131.18 g/mol, XLogP of -0.91, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(hydroxymethyl)pyrrolidin-2-yl]methanol is sourced from PubChem (CID 55287598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).