2-(2,3-dihydrofuran-4-yl)-1-pyrrolidin-2-ylpropan-2-ol

C11H19NO2 — CID 130948690

IUPAC2-(2,3-dihydrofuran-4-yl)-1-pyrrolidin-2-ylpropan-2-ol
SMILESCC(O)(CC1CCCN1)C1=COCC1
InChIInChI=1S/C11H19NO2/c1-11(13,9-4-6-14-8-9)7-10-3-2-5-12-10/h8,10,12-13H,2-7H2,1H3
InChIKeyHPOANKDZLUAKBR-UHFFFAOYSA-N
MW197.28 g/mol
LogP1.18
Rot. Bonds3

About 2-(2,3-dihydrofuran-4-yl)-1-pyrrolidin-2-ylpropan-2-ol

2-(2,3-dihydrofuran-4-yl)-1-pyrrolidin-2-ylpropan-2-ol (PubChem CID 130948690) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is 2-(2,3-dihydrofuran-4-yl)-1-pyrrolidin-2-ylpropan-2-ol.

Molecular Properties

Compound Name2-(2,3-dihydrofuran-4-yl)-1-pyrrolidin-2-ylpropan-2-ol
PubChem CID130948690
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Name2-(2,3-dihydrofuran-4-yl)-1-pyrrolidin-2-ylpropan-2-ol
SMILESCC(O)(CC1CCCN1)C1=COCC1
InChIInChI=1S/C11H19NO2/c1-11(13,9-4-6-14-8-9)7-10-3-2-5-12-10/h8,10,12-13H,2-7H2,1H3
InChIKeyHPOANKDZLUAKBR-UHFFFAOYSA-N
XLogP1.18
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydrofuran-4-yl)-1-pyrrolidin-2-ylpropan-2-ol?
The IUPAC name of 2-(2,3-dihydrofuran-4-yl)-1-pyrrolidin-2-ylpropan-2-ol (CID 130948690) is 2-(2,3-dihydrofuran-4-yl)-1-pyrrolidin-2-ylpropan-2-ol.
What is the SMILES notation for 2-(2,3-dihydrofuran-4-yl)-1-pyrrolidin-2-ylpropan-2-ol?
The canonical SMILES for 2-(2,3-dihydrofuran-4-yl)-1-pyrrolidin-2-ylpropan-2-ol is CC(O)(CC1CCCN1)C1=COCC1.
What is the InChIKey of 2-(2,3-dihydrofuran-4-yl)-1-pyrrolidin-2-ylpropan-2-ol?
The InChIKey is HPOANKDZLUAKBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c1-11(13,9-4-6-14-8-9)7-10-3-2-5-12-10/h8,10,12-13H,2-7H2,1H3.
What are the key properties of 2-(2,3-dihydrofuran-4-yl)-1-pyrrolidin-2-ylpropan-2-ol?
2-(2,3-dihydrofuran-4-yl)-1-pyrrolidin-2-ylpropan-2-ol has a molecular weight of 197.28 g/mol, XLogP of 1.18, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydrofuran-4-yl)-1-pyrrolidin-2-ylpropan-2-ol is sourced from PubChem (CID 130948690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).