3-(furan-3-yl)-1-pyrrolidin-1-ylpropan-1-one

C11H15NO2 — CID 127053815

IUPAC3-(furan-3-yl)-1-pyrrolidin-1-ylpropan-1-one
SMILESO=C(CCc1ccoc1)N1CCCC1
InChIInChI=1S/C11H15NO2/c13-11(12-6-1-2-7-12)4-3-10-5-8-14-9-10/h5,8-9H,1-4,6-7H2
InChIKeySGKPSOSDSZDXFD-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.83
Rot. Bonds3

About 3-(furan-3-yl)-1-pyrrolidin-1-ylpropan-1-one

3-(furan-3-yl)-1-pyrrolidin-1-ylpropan-1-one (PubChem CID 127053815) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is 3-(furan-3-yl)-1-pyrrolidin-1-ylpropan-1-one.

Molecular Properties

Compound Name3-(furan-3-yl)-1-pyrrolidin-1-ylpropan-1-one
PubChem CID127053815
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Name3-(furan-3-yl)-1-pyrrolidin-1-ylpropan-1-one
SMILESO=C(CCc1ccoc1)N1CCCC1
InChIInChI=1S/C11H15NO2/c13-11(12-6-1-2-7-12)4-3-10-5-8-14-9-10/h5,8-9H,1-4,6-7H2
InChIKeySGKPSOSDSZDXFD-UHFFFAOYSA-N
XLogP1.83
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(furan-3-yl)-1-pyrrolidin-1-ylpropan-1-one?
The IUPAC name of 3-(furan-3-yl)-1-pyrrolidin-1-ylpropan-1-one (CID 127053815) is 3-(furan-3-yl)-1-pyrrolidin-1-ylpropan-1-one.
What is the SMILES notation for 3-(furan-3-yl)-1-pyrrolidin-1-ylpropan-1-one?
The canonical SMILES for 3-(furan-3-yl)-1-pyrrolidin-1-ylpropan-1-one is O=C(CCc1ccoc1)N1CCCC1.
What is the InChIKey of 3-(furan-3-yl)-1-pyrrolidin-1-ylpropan-1-one?
The InChIKey is SGKPSOSDSZDXFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2/c13-11(12-6-1-2-7-12)4-3-10-5-8-14-9-10/h5,8-9H,1-4,6-7H2.
What are the key properties of 3-(furan-3-yl)-1-pyrrolidin-1-ylpropan-1-one?
3-(furan-3-yl)-1-pyrrolidin-1-ylpropan-1-one has a molecular weight of 193.25 g/mol, XLogP of 1.83, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-3-yl)-1-pyrrolidin-1-ylpropan-1-one is sourced from PubChem (CID 127053815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).