1-(2-fluoroethyl)-3-(methoxymethyl)pyrrolidine

C8H16FNO — CID 131222844

IUPAC1-(2-fluoroethyl)-3-(methoxymethyl)pyrrolidine
SMILESCOCC1CCN(CCF)C1
InChIInChI=1S/C8H16FNO/c1-11-7-8-2-4-10(6-8)5-3-9/h8H,2-7H2,1H3
InChIKeyFTMDOZXMCHBZFG-UHFFFAOYSA-N
MW161.22 g/mol
LogP0.92
Rot. Bonds4

About 1-(2-fluoroethyl)-3-(methoxymethyl)pyrrolidine

1-(2-fluoroethyl)-3-(methoxymethyl)pyrrolidine (PubChem CID 131222844) has the molecular formula C8H16FNO and a molecular weight of 161.22 g/mol. Its IUPAC name is 1-(2-fluoroethyl)-3-(methoxymethyl)pyrrolidine.

Molecular Properties

Compound Name1-(2-fluoroethyl)-3-(methoxymethyl)pyrrolidine
PubChem CID131222844
Molecular FormulaC8H16FNO
Molecular Weight161.22 g/mol
Exact Mass161.12
IUPAC Name1-(2-fluoroethyl)-3-(methoxymethyl)pyrrolidine
SMILESCOCC1CCN(CCF)C1
InChIInChI=1S/C8H16FNO/c1-11-7-8-2-4-10(6-8)5-3-9/h8H,2-7H2,1H3
InChIKeyFTMDOZXMCHBZFG-UHFFFAOYSA-N
XLogP0.92
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.22
LogP ≤ 50.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-(N,N-diethylaminomethyl)tetrahydrofuran
CID 14323080
(3S)-1-(2,2-difluoroethyl)-3-(2-methoxyethoxymethyl)pyrrolidine
CID 96089847
3-Fluoro-1-(3-methoxypropyl)pyrrolidine
CID 89037355
3-(Ethoxymethyl)-3-fluoro-1-methylpyrrolidine
CID 90165373
3-Fluoro-1-methyl-3-(propan-2-yloxymethyl)pyrrolidine
CID 122547217
3-Fluoro-3-(methoxymethyl)-1-methylpyrrolidine
CID 122549628
(3S)-3-fluoro-1-(3-methoxypropyl)pyrrolidine
CID 130270256
(3R)-3-fluoro-1-(3-methoxypropyl)pyrrolidine
CID 130270427
[3-Fluoro-1-(2-methylpropyl)pyrrolidin-3-yl]methanol
CID 131089403
3-(Difluoromethoxymethyl)-1-methylpyrrolidine
CID 131106863
(3S)-3-fluoro-1-methyl-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine
CID 139364499
N-[difluoro(oxolan-3-yl)methyl]-N-ethylethanamine
CID 140159606

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluoroethyl)-3-(methoxymethyl)pyrrolidine?
The IUPAC name of 1-(2-fluoroethyl)-3-(methoxymethyl)pyrrolidine (CID 131222844) is 1-(2-fluoroethyl)-3-(methoxymethyl)pyrrolidine.
What is the SMILES notation for 1-(2-fluoroethyl)-3-(methoxymethyl)pyrrolidine?
The canonical SMILES for 1-(2-fluoroethyl)-3-(methoxymethyl)pyrrolidine is COCC1CCN(CCF)C1.
What is the InChIKey of 1-(2-fluoroethyl)-3-(methoxymethyl)pyrrolidine?
The InChIKey is FTMDOZXMCHBZFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16FNO/c1-11-7-8-2-4-10(6-8)5-3-9/h8H,2-7H2,1H3.
What are the key properties of 1-(2-fluoroethyl)-3-(methoxymethyl)pyrrolidine?
1-(2-fluoroethyl)-3-(methoxymethyl)pyrrolidine has a molecular weight of 161.22 g/mol, XLogP of 0.92, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoroethyl)-3-(methoxymethyl)pyrrolidine is sourced from PubChem (CID 131222844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).