2-[4-fluoro-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethanol

C10H20FNO2 — CID 177272168

IUPAC2-[4-fluoro-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethanol
SMILESCC(C)OCC1CC(F)CN1CCO
InChIInChI=1S/C10H20FNO2/c1-8(2)14-7-10-5-9(11)6-12(10)3-4-13/h8-10,13H,3-7H2,1-2H3
InChIKeyFALSKPKROJDCIB-UHFFFAOYSA-N
MW205.27 g/mol
LogP0.82
Rot. Bonds5

About 2-[4-fluoro-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethanol

2-[4-fluoro-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethanol (PubChem CID 177272168) has the molecular formula C10H20FNO2 and a molecular weight of 205.27 g/mol. Its IUPAC name is 2-[4-fluoro-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethanol.

Molecular Properties

Compound Name2-[4-fluoro-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethanol
PubChem CID177272168
Molecular FormulaC10H20FNO2
Molecular Weight205.27 g/mol
Exact Mass205.15
IUPAC Name2-[4-fluoro-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethanol
SMILESCC(C)OCC1CC(F)CN1CCO
InChIInChI=1S/C10H20FNO2/c1-8(2)14-7-10-5-9(11)6-12(10)3-4-13/h8-10,13H,3-7H2,1-2H3
InChIKeyFALSKPKROJDCIB-UHFFFAOYSA-N
XLogP0.82
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.27
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

((2S)-1-(2-methoxyethyl)pyrrolidin-2-yl)methanol
CID 59701827
[(2S,4R)-4-methoxy-1-methylpyrrolidin-2-yl]methanol
CID 59971151
[(2S,4S)-4-methoxy-1-methylpyrrolidin-2-yl]methanol hydrochloride
CID 145913684
((2S,4R)-4-methoxy-1-methylpyrrolidin-2-yl)methanol hydrochloride
CID 165589760
3-[[(2S,4S)-4-fluoro-1-methylpyrrolidin-2-yl]methoxy]propan-1-ol
CID 58778737
4-[[(2S,4S)-4-fluoro-1-methylpyrrolidin-2-yl]methoxy]butan-1-ol
CID 58778782
((2S,4S)-4-Methoxy-1-methylpyrrolidin-2-yl)methanol
CID 58903082
2-(Ethoxymethyl)-4-fluoro-1-methylpyrrolidine
CID 76646808
(2S,4R)-1-ethyl-4-fluoro-2-(methoxymethyl)pyrrolidine
CID 89317886
4-Fluoro-2-(2-methoxyethoxymethyl)-1-methylpyrrolidine
CID 126542183
(4-Fluoro-1-propan-2-ylpyrrolidin-2-yl)methanol
CID 126997673
[(2S,4S)-4-fluoro-1-propan-2-ylpyrrolidin-2-yl]methanol
CID 130757224

Frequently Asked Questions

What is the IUPAC name of 2-[4-fluoro-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethanol?
The IUPAC name of 2-[4-fluoro-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethanol (CID 177272168) is 2-[4-fluoro-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethanol.
What is the SMILES notation for 2-[4-fluoro-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethanol?
The canonical SMILES for 2-[4-fluoro-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethanol is CC(C)OCC1CC(F)CN1CCO.
What is the InChIKey of 2-[4-fluoro-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethanol?
The InChIKey is FALSKPKROJDCIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20FNO2/c1-8(2)14-7-10-5-9(11)6-12(10)3-4-13/h8-10,13H,3-7H2,1-2H3.
What are the key properties of 2-[4-fluoro-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethanol?
2-[4-fluoro-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethanol has a molecular weight of 205.27 g/mol, XLogP of 0.82, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-fluoro-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethanol is sourced from PubChem (CID 177272168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).