2-(trifluoromethoxymethyl)pyrrolidine

C6H10F3NO — CID 53406432

IUPAC2-(trifluoromethoxymethyl)pyrrolidine
SMILESFC(F)(F)OCC1CCCN1
InChIInChI=1S/C6H10F3NO/c7-6(8,9)11-4-5-2-1-3-10-5/h5,10H,1-4H2
InChIKeyMJYDHIRDMFNTEZ-UHFFFAOYSA-N
MW169.15 g/mol
LogP1.27
Rot. Bonds2

About 2-(trifluoromethoxymethyl)pyrrolidine

2-(trifluoromethoxymethyl)pyrrolidine (PubChem CID 53406432) has the molecular formula C6H10F3NO and a molecular weight of 169.15 g/mol. Its IUPAC name is 2-(trifluoromethoxymethyl)pyrrolidine.

Molecular Properties

Compound Name2-(trifluoromethoxymethyl)pyrrolidine
PubChem CID53406432
Molecular FormulaC6H10F3NO
Molecular Weight169.15 g/mol
Exact Mass169.07
IUPAC Name2-(trifluoromethoxymethyl)pyrrolidine
SMILESFC(F)(F)OCC1CCCN1
InChIInChI=1S/C6H10F3NO/c7-6(8,9)11-4-5-2-1-3-10-5/h5,10H,1-4H2
InChIKeyMJYDHIRDMFNTEZ-UHFFFAOYSA-N
XLogP1.27
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.15
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(trifluoromethoxymethyl)pyrrolidine?
The IUPAC name of 2-(trifluoromethoxymethyl)pyrrolidine (CID 53406432) is 2-(trifluoromethoxymethyl)pyrrolidine.
What is the SMILES notation for 2-(trifluoromethoxymethyl)pyrrolidine?
The canonical SMILES for 2-(trifluoromethoxymethyl)pyrrolidine is FC(F)(F)OCC1CCCN1.
What is the InChIKey of 2-(trifluoromethoxymethyl)pyrrolidine?
The InChIKey is MJYDHIRDMFNTEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F3NO/c7-6(8,9)11-4-5-2-1-3-10-5/h5,10H,1-4H2.
What are the key properties of 2-(trifluoromethoxymethyl)pyrrolidine?
2-(trifluoromethoxymethyl)pyrrolidine has a molecular weight of 169.15 g/mol, XLogP of 1.27, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(trifluoromethoxymethyl)pyrrolidine is sourced from PubChem (CID 53406432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).