3-(furan-2-yl)pyrrolidine

C8H11NO — CID 52988233

IUPAC3-(furan-2-yl)pyrrolidine
SMILESc1coc(C2CCNC2)c1
InChIInChI=1S/C8H11NO/c1-2-8(10-5-1)7-3-4-9-6-7/h1-2,5,7,9H,3-4,6H2
InChIKeyJZUXVUVOBBUMGK-UHFFFAOYSA-N
MW137.18 g/mol
LogP1.36
Rot. Bonds1

About 3-(furan-2-yl)pyrrolidine

3-(furan-2-yl)pyrrolidine (PubChem CID 52988233) has the molecular formula C8H11NO and a molecular weight of 137.18 g/mol. Its IUPAC name is 3-(furan-2-yl)pyrrolidine.

Molecular Properties

Compound Name3-(furan-2-yl)pyrrolidine
PubChem CID52988233
Molecular FormulaC8H11NO
Molecular Weight137.18 g/mol
Exact Mass137.08
IUPAC Name3-(furan-2-yl)pyrrolidine
SMILESc1coc(C2CCNC2)c1
InChIInChI=1S/C8H11NO/c1-2-8(10-5-1)7-3-4-9-6-7/h1-2,5,7,9H,3-4,6H2
InChIKeyJZUXVUVOBBUMGK-UHFFFAOYSA-N
XLogP1.36
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.18
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(furan-2-yl)pyrrolidine?
The IUPAC name of 3-(furan-2-yl)pyrrolidine (CID 52988233) is 3-(furan-2-yl)pyrrolidine.
What is the SMILES notation for 3-(furan-2-yl)pyrrolidine?
The canonical SMILES for 3-(furan-2-yl)pyrrolidine is c1coc(C2CCNC2)c1.
What is the InChIKey of 3-(furan-2-yl)pyrrolidine?
The InChIKey is JZUXVUVOBBUMGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO/c1-2-8(10-5-1)7-3-4-9-6-7/h1-2,5,7,9H,3-4,6H2.
What are the key properties of 3-(furan-2-yl)pyrrolidine?
3-(furan-2-yl)pyrrolidine has a molecular weight of 137.18 g/mol, XLogP of 1.36, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-2-yl)pyrrolidine is sourced from PubChem (CID 52988233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).