3-(2-fluoroethyl)pyrrolidine

C6H12FN — CID 53409225

IUPAC3-(2-fluoroethyl)pyrrolidine
SMILESFCCC1CCNC1
InChIInChI=1S/C6H12FN/c7-3-1-6-2-4-8-5-6/h6,8H,1-5H2
InChIKeyUQIDGDMXALVLSR-UHFFFAOYSA-N
MW117.17 g/mol
LogP0.96
Rot. Bonds2

About 3-(2-fluoroethyl)pyrrolidine

3-(2-fluoroethyl)pyrrolidine (PubChem CID 53409225) has the molecular formula C6H12FN and a molecular weight of 117.17 g/mol. Its IUPAC name is 3-(2-fluoroethyl)pyrrolidine.

Molecular Properties

Compound Name3-(2-fluoroethyl)pyrrolidine
PubChem CID53409225
Molecular FormulaC6H12FN
Molecular Weight117.17 g/mol
Exact Mass117.10
IUPAC Name3-(2-fluoroethyl)pyrrolidine
SMILESFCCC1CCNC1
InChIInChI=1S/C6H12FN/c7-3-1-6-2-4-8-5-6/h6,8H,1-5H2
InChIKeyUQIDGDMXALVLSR-UHFFFAOYSA-N
XLogP0.96
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.17
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-Propylpyrrolidine
CID 12648198
3-Ethylpyrrolidine
CID 12648195
2,3-Dimethylpyrrolidine
CID 21539078
3-(2,2,2-Trifluoroethyl)pyrrolidine hydrochloride
CID 50988606
3-Ethylpyrrolidine hydrochloride
CID 71755796
3-(Fluoromethyl)pyrrolidine hydrochloride
CID 84716215
(R)-3-(Fluoromethyl)pyrrolidine hydrochloride
CID 89619639
2-Methyl-3-(trifluoromethyl)pyrrolidine hydrochloride
CID 91647524
(3R)-3-ethylpyrrolidine hydrochloride
CID 118796251
(3S)-3-ethylpyrrolidine hydrochloride
CID 118796252
(3S)-3-(fluoromethyl)pyrrolidine hydrochloride
CID 133547166
3-(2,2-Difluoroethyl)pyrrolidine hydrochloride
CID 137965821

Frequently Asked Questions

What is the IUPAC name of 3-(2-fluoroethyl)pyrrolidine?
The IUPAC name of 3-(2-fluoroethyl)pyrrolidine (CID 53409225) is 3-(2-fluoroethyl)pyrrolidine.
What is the SMILES notation for 3-(2-fluoroethyl)pyrrolidine?
The canonical SMILES for 3-(2-fluoroethyl)pyrrolidine is FCCC1CCNC1.
What is the InChIKey of 3-(2-fluoroethyl)pyrrolidine?
The InChIKey is UQIDGDMXALVLSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12FN/c7-3-1-6-2-4-8-5-6/h6,8H,1-5H2.
What are the key properties of 3-(2-fluoroethyl)pyrrolidine?
3-(2-fluoroethyl)pyrrolidine has a molecular weight of 117.17 g/mol, XLogP of 0.96, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluoroethyl)pyrrolidine is sourced from PubChem (CID 53409225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).