3-[1-(trifluoromethyl)cyclopropyl]pyrrolidine

C8H12F3N — CID 83906289

IUPAC3-[1-(trifluoromethyl)cyclopropyl]pyrrolidine
SMILESFC(F)(F)C1(C2CCNC2)CC1
InChIInChI=1S/C8H12F3N/c9-8(10,11)7(2-3-7)6-1-4-12-5-6/h6,12H,1-5H2
InChIKeyRTZAHGBBBQYEFM-UHFFFAOYSA-N
MW179.18 g/mol
LogP1.94
Rot. Bonds1

About 3-[1-(trifluoromethyl)cyclopropyl]pyrrolidine

3-[1-(trifluoromethyl)cyclopropyl]pyrrolidine (PubChem CID 83906289) has the molecular formula C8H12F3N and a molecular weight of 179.18 g/mol. Its IUPAC name is 3-[1-(trifluoromethyl)cyclopropyl]pyrrolidine.

Molecular Properties

Compound Name3-[1-(trifluoromethyl)cyclopropyl]pyrrolidine
PubChem CID83906289
Molecular FormulaC8H12F3N
Molecular Weight179.18 g/mol
Exact Mass179.09
IUPAC Name3-[1-(trifluoromethyl)cyclopropyl]pyrrolidine
SMILESFC(F)(F)C1(C2CCNC2)CC1
InChIInChI=1S/C8H12F3N/c9-8(10,11)7(2-3-7)6-1-4-12-5-6/h6,12H,1-5H2
InChIKeyRTZAHGBBBQYEFM-UHFFFAOYSA-N
XLogP1.94
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.18
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-[1-(trifluoromethyl)cyclopropyl]pyrrolidine?
The IUPAC name of 3-[1-(trifluoromethyl)cyclopropyl]pyrrolidine (CID 83906289) is 3-[1-(trifluoromethyl)cyclopropyl]pyrrolidine.
What is the SMILES notation for 3-[1-(trifluoromethyl)cyclopropyl]pyrrolidine?
The canonical SMILES for 3-[1-(trifluoromethyl)cyclopropyl]pyrrolidine is FC(F)(F)C1(C2CCNC2)CC1.
What is the InChIKey of 3-[1-(trifluoromethyl)cyclopropyl]pyrrolidine?
The InChIKey is RTZAHGBBBQYEFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12F3N/c9-8(10,11)7(2-3-7)6-1-4-12-5-6/h6,12H,1-5H2.
What are the key properties of 3-[1-(trifluoromethyl)cyclopropyl]pyrrolidine?
3-[1-(trifluoromethyl)cyclopropyl]pyrrolidine has a molecular weight of 179.18 g/mol, XLogP of 1.94, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(trifluoromethyl)cyclopropyl]pyrrolidine is sourced from PubChem (CID 83906289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).