3-[5-(trifluoromethyl)furan-2-yl]pyrrolidine

C9H10F3NO — CID 82659069

IUPAC3-[5-(trifluoromethyl)furan-2-yl]pyrrolidine
SMILESFC(F)(F)c1ccc(C2CCNC2)o1
InChIInChI=1S/C9H10F3NO/c10-9(11,12)8-2-1-7(14-8)6-3-4-13-5-6/h1-2,6,13H,3-5H2
InChIKeyCAWHSTFIVAOQHK-UHFFFAOYSA-N
MW205.18 g/mol
LogP2.38
Rot. Bonds1

About 3-[5-(trifluoromethyl)furan-2-yl]pyrrolidine

3-[5-(trifluoromethyl)furan-2-yl]pyrrolidine (PubChem CID 82659069) has the molecular formula C9H10F3NO and a molecular weight of 205.18 g/mol. Its IUPAC name is 3-[5-(trifluoromethyl)furan-2-yl]pyrrolidine.

Molecular Properties

Compound Name3-[5-(trifluoromethyl)furan-2-yl]pyrrolidine
PubChem CID82659069
Molecular FormulaC9H10F3NO
Molecular Weight205.18 g/mol
Exact Mass205.07
IUPAC Name3-[5-(trifluoromethyl)furan-2-yl]pyrrolidine
SMILESFC(F)(F)c1ccc(C2CCNC2)o1
InChIInChI=1S/C9H10F3NO/c10-9(11,12)8-2-1-7(14-8)6-3-4-13-5-6/h1-2,6,13H,3-5H2
InChIKeyCAWHSTFIVAOQHK-UHFFFAOYSA-N
XLogP2.38
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.18
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-[5-(trifluoromethyl)furan-2-yl]pyrrolidine?
The IUPAC name of 3-[5-(trifluoromethyl)furan-2-yl]pyrrolidine (CID 82659069) is 3-[5-(trifluoromethyl)furan-2-yl]pyrrolidine.
What is the SMILES notation for 3-[5-(trifluoromethyl)furan-2-yl]pyrrolidine?
The canonical SMILES for 3-[5-(trifluoromethyl)furan-2-yl]pyrrolidine is FC(F)(F)c1ccc(C2CCNC2)o1.
What is the InChIKey of 3-[5-(trifluoromethyl)furan-2-yl]pyrrolidine?
The InChIKey is CAWHSTFIVAOQHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10F3NO/c10-9(11,12)8-2-1-7(14-8)6-3-4-13-5-6/h1-2,6,13H,3-5H2.
What are the key properties of 3-[5-(trifluoromethyl)furan-2-yl]pyrrolidine?
3-[5-(trifluoromethyl)furan-2-yl]pyrrolidine has a molecular weight of 205.18 g/mol, XLogP of 2.38, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-(trifluoromethyl)furan-2-yl]pyrrolidine is sourced from PubChem (CID 82659069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).