2-(oxolan-3-yl)-3-pyrrolidin-1-ylpropan-1-ol

C11H21NO2 — CID 117237628

IUPAC2-(oxolan-3-yl)-3-pyrrolidin-1-ylpropan-1-ol
SMILESOCC(CN1CCCC1)C1CCOC1
InChIInChI=1S/C11H21NO2/c13-8-11(10-3-6-14-9-10)7-12-4-1-2-5-12/h10-11,13H,1-9H2
InChIKeyFTUGYZMFRYXLIB-UHFFFAOYSA-N
MW199.29 g/mol
LogP0.73
Rot. Bonds4

About 2-(oxolan-3-yl)-3-pyrrolidin-1-ylpropan-1-ol

2-(oxolan-3-yl)-3-pyrrolidin-1-ylpropan-1-ol (PubChem CID 117237628) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is 2-(oxolan-3-yl)-3-pyrrolidin-1-ylpropan-1-ol.

Molecular Properties

Compound Name2-(oxolan-3-yl)-3-pyrrolidin-1-ylpropan-1-ol
PubChem CID117237628
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name2-(oxolan-3-yl)-3-pyrrolidin-1-ylpropan-1-ol
SMILESOCC(CN1CCCC1)C1CCOC1
InChIInChI=1S/C11H21NO2/c13-8-11(10-3-6-14-9-10)7-12-4-1-2-5-12/h10-11,13H,1-9H2
InChIKeyFTUGYZMFRYXLIB-UHFFFAOYSA-N
XLogP0.73
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(oxolan-3-yl)-3-pyrrolidin-1-ylpropan-1-ol?
The IUPAC name of 2-(oxolan-3-yl)-3-pyrrolidin-1-ylpropan-1-ol (CID 117237628) is 2-(oxolan-3-yl)-3-pyrrolidin-1-ylpropan-1-ol.
What is the SMILES notation for 2-(oxolan-3-yl)-3-pyrrolidin-1-ylpropan-1-ol?
The canonical SMILES for 2-(oxolan-3-yl)-3-pyrrolidin-1-ylpropan-1-ol is OCC(CN1CCCC1)C1CCOC1.
What is the InChIKey of 2-(oxolan-3-yl)-3-pyrrolidin-1-ylpropan-1-ol?
The InChIKey is FTUGYZMFRYXLIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c13-8-11(10-3-6-14-9-10)7-12-4-1-2-5-12/h10-11,13H,1-9H2.
What are the key properties of 2-(oxolan-3-yl)-3-pyrrolidin-1-ylpropan-1-ol?
2-(oxolan-3-yl)-3-pyrrolidin-1-ylpropan-1-ol has a molecular weight of 199.29 g/mol, XLogP of 0.73, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxolan-3-yl)-3-pyrrolidin-1-ylpropan-1-ol is sourced from PubChem (CID 117237628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).