furan-2-yl-[3-(trifluoromethyl)pyrrolidin-3-yl]methanone

C10H10F3NO2 — CID 116572943

IUPACfuran-2-yl-[3-(trifluoromethyl)pyrrolidin-3-yl]methanone
SMILESO=C(c1ccco1)C1(C(F)(F)F)CCNC1
InChIInChI=1S/C10H10F3NO2/c11-10(12,13)9(3-4-14-6-9)8(15)7-2-1-5-16-7/h1-2,5,14H,3-4,6H2
InChIKeyRJUUCJOWVFTDSG-UHFFFAOYSA-N
MW233.19 g/mol
LogP2.00
Rot. Bonds2

About furan-2-yl-[3-(trifluoromethyl)pyrrolidin-3-yl]methanone

furan-2-yl-[3-(trifluoromethyl)pyrrolidin-3-yl]methanone (PubChem CID 116572943) has the molecular formula C10H10F3NO2 and a molecular weight of 233.19 g/mol. Its IUPAC name is furan-2-yl-[3-(trifluoromethyl)pyrrolidin-3-yl]methanone.

Molecular Properties

Compound Namefuran-2-yl-[3-(trifluoromethyl)pyrrolidin-3-yl]methanone
PubChem CID116572943
Molecular FormulaC10H10F3NO2
Molecular Weight233.19 g/mol
Exact Mass233.07
IUPAC Namefuran-2-yl-[3-(trifluoromethyl)pyrrolidin-3-yl]methanone
SMILESO=C(c1ccco1)C1(C(F)(F)F)CCNC1
InChIInChI=1S/C10H10F3NO2/c11-10(12,13)9(3-4-14-6-9)8(15)7-2-1-5-16-7/h1-2,5,14H,3-4,6H2
InChIKeyRJUUCJOWVFTDSG-UHFFFAOYSA-N
XLogP2.00
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.19
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of furan-2-yl-[3-(trifluoromethyl)pyrrolidin-3-yl]methanone?
The IUPAC name of furan-2-yl-[3-(trifluoromethyl)pyrrolidin-3-yl]methanone (CID 116572943) is furan-2-yl-[3-(trifluoromethyl)pyrrolidin-3-yl]methanone.
What is the SMILES notation for furan-2-yl-[3-(trifluoromethyl)pyrrolidin-3-yl]methanone?
The canonical SMILES for furan-2-yl-[3-(trifluoromethyl)pyrrolidin-3-yl]methanone is O=C(c1ccco1)C1(C(F)(F)F)CCNC1.
What is the InChIKey of furan-2-yl-[3-(trifluoromethyl)pyrrolidin-3-yl]methanone?
The InChIKey is RJUUCJOWVFTDSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F3NO2/c11-10(12,13)9(3-4-14-6-9)8(15)7-2-1-5-16-7/h1-2,5,14H,3-4,6H2.
What are the key properties of furan-2-yl-[3-(trifluoromethyl)pyrrolidin-3-yl]methanone?
furan-2-yl-[3-(trifluoromethyl)pyrrolidin-3-yl]methanone has a molecular weight of 233.19 g/mol, XLogP of 2.00, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for furan-2-yl-[3-(trifluoromethyl)pyrrolidin-3-yl]methanone is sourced from PubChem (CID 116572943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).