3-(furan-3-yl)pyrrolidine

C8H11NO — CID 63207902

IUPAC3-(furan-3-yl)pyrrolidine
SMILESc1cc(C2CCNC2)co1
InChIInChI=1S/C8H11NO/c1-3-9-5-7(1)8-2-4-10-6-8/h2,4,6-7,9H,1,3,5H2
InChIKeyPDSIHZMGHLAXCG-UHFFFAOYSA-N
MW137.18 g/mol
LogP1.36
Rot. Bonds1

About 3-(furan-3-yl)pyrrolidine

3-(furan-3-yl)pyrrolidine (PubChem CID 63207902) has the molecular formula C8H11NO and a molecular weight of 137.18 g/mol. Its IUPAC name is 3-(furan-3-yl)pyrrolidine.

Molecular Properties

Compound Name3-(furan-3-yl)pyrrolidine
PubChem CID63207902
Molecular FormulaC8H11NO
Molecular Weight137.18 g/mol
Exact Mass137.08
IUPAC Name3-(furan-3-yl)pyrrolidine
SMILESc1cc(C2CCNC2)co1
InChIInChI=1S/C8H11NO/c1-3-9-5-7(1)8-2-4-10-6-8/h2,4,6-7,9H,1,3,5H2
InChIKeyPDSIHZMGHLAXCG-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-3-yl)pyrrolidine?
The IUPAC name of 3-(furan-3-yl)pyrrolidine (CID 63207902) is 3-(furan-3-yl)pyrrolidine.
What is the SMILES notation for 3-(furan-3-yl)pyrrolidine?
The canonical SMILES for 3-(furan-3-yl)pyrrolidine is c1cc(C2CCNC2)co1.
What is the InChIKey of 3-(furan-3-yl)pyrrolidine?
The InChIKey is PDSIHZMGHLAXCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO/c1-3-9-5-7(1)8-2-4-10-6-8/h2,4,6-7,9H,1,3,5H2.
What are the key properties of 3-(furan-3-yl)pyrrolidine?
3-(furan-3-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-3-yl)pyrrolidine is sourced from PubChem (CID 63207902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).