2-pyrrolidin-3-yloxyethanol

C6H13NO2 — CID 67294250

IUPAC2-pyrrolidin-3-yloxyethanol
SMILESOCCOC1CCNC1
InChIInChI=1S/C6H13NO2/c8-3-4-9-6-1-2-7-5-6/h6-8H,1-5H2
InChIKeyYFWIGXMOOQLHQR-UHFFFAOYSA-N
MW131.18 g/mol
LogP-0.64
Rot. Bonds3

About 2-pyrrolidin-3-yloxyethanol

2-pyrrolidin-3-yloxyethanol (PubChem CID 67294250) has the molecular formula C6H13NO2 and a molecular weight of 131.18 g/mol. Its IUPAC name is 2-pyrrolidin-3-yloxyethanol.

Molecular Properties

Compound Name2-pyrrolidin-3-yloxyethanol
PubChem CID67294250
Molecular FormulaC6H13NO2
Molecular Weight131.18 g/mol
Exact Mass131.09
IUPAC Name2-pyrrolidin-3-yloxyethanol
SMILESOCCOC1CCNC1
InChIInChI=1S/C6H13NO2/c8-3-4-9-6-1-2-7-5-6/h6-8H,1-5H2
InChIKeyYFWIGXMOOQLHQR-UHFFFAOYSA-N
XLogP-0.64
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.18
LogP ≤ 5-0.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-pyrrolidin-3-yloxyethanol?
The IUPAC name of 2-pyrrolidin-3-yloxyethanol (CID 67294250) is 2-pyrrolidin-3-yloxyethanol.
What is the SMILES notation for 2-pyrrolidin-3-yloxyethanol?
The canonical SMILES for 2-pyrrolidin-3-yloxyethanol is OCCOC1CCNC1.
What is the InChIKey of 2-pyrrolidin-3-yloxyethanol?
The InChIKey is YFWIGXMOOQLHQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO2/c8-3-4-9-6-1-2-7-5-6/h6-8H,1-5H2.
What are the key properties of 2-pyrrolidin-3-yloxyethanol?
2-pyrrolidin-3-yloxyethanol has a molecular weight of 131.18 g/mol, XLogP of -0.64, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrrolidin-3-yloxyethanol is sourced from PubChem (CID 67294250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).