3-fluoro-3-(methoxymethyl)-1-(3-methylcyclopentyl)pyrrolidine

C12H22FNO — CID 154971742

IUPAC3-fluoro-3-(methoxymethyl)-1-(3-methylcyclopentyl)pyrrolidine
SMILESCOCC1(F)CCN(C2CCC(C)C2)C1
InChIInChI=1S/C12H22FNO/c1-10-3-4-11(7-10)14-6-5-12(13,8-14)9-15-2/h10-11H,3-9H2,1-2H3
InChIKeyPOGOOIVRBUEESD-UHFFFAOYSA-N
MW215.31 g/mol
LogP2.24
Rot. Bonds3

About 3-fluoro-3-(methoxymethyl)-1-(3-methylcyclopentyl)pyrrolidine

3-fluoro-3-(methoxymethyl)-1-(3-methylcyclopentyl)pyrrolidine (PubChem CID 154971742) has the molecular formula C12H22FNO and a molecular weight of 215.31 g/mol. Its IUPAC name is 3-fluoro-3-(methoxymethyl)-1-(3-methylcyclopentyl)pyrrolidine.

Molecular Properties

Compound Name3-fluoro-3-(methoxymethyl)-1-(3-methylcyclopentyl)pyrrolidine
PubChem CID154971742
Molecular FormulaC12H22FNO
Molecular Weight215.31 g/mol
Exact Mass215.17
IUPAC Name3-fluoro-3-(methoxymethyl)-1-(3-methylcyclopentyl)pyrrolidine
SMILESCOCC1(F)CCN(C2CCC(C)C2)C1
InChIInChI=1S/C12H22FNO/c1-10-3-4-11(7-10)14-6-5-12(13,8-14)9-15-2/h10-11H,3-9H2,1-2H3
InChIKeyPOGOOIVRBUEESD-UHFFFAOYSA-N
XLogP2.24
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.31
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-3-(methoxymethyl)-1-(3-methylcyclopentyl)pyrrolidine?
The IUPAC name of 3-fluoro-3-(methoxymethyl)-1-(3-methylcyclopentyl)pyrrolidine (CID 154971742) is 3-fluoro-3-(methoxymethyl)-1-(3-methylcyclopentyl)pyrrolidine.
What is the SMILES notation for 3-fluoro-3-(methoxymethyl)-1-(3-methylcyclopentyl)pyrrolidine?
The canonical SMILES for 3-fluoro-3-(methoxymethyl)-1-(3-methylcyclopentyl)pyrrolidine is COCC1(F)CCN(C2CCC(C)C2)C1.
What is the InChIKey of 3-fluoro-3-(methoxymethyl)-1-(3-methylcyclopentyl)pyrrolidine?
The InChIKey is POGOOIVRBUEESD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22FNO/c1-10-3-4-11(7-10)14-6-5-12(13,8-14)9-15-2/h10-11H,3-9H2,1-2H3.
What are the key properties of 3-fluoro-3-(methoxymethyl)-1-(3-methylcyclopentyl)pyrrolidine?
3-fluoro-3-(methoxymethyl)-1-(3-methylcyclopentyl)pyrrolidine has a molecular weight of 215.31 g/mol, XLogP of 2.24, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-3-(methoxymethyl)-1-(3-methylcyclopentyl)pyrrolidine is sourced from PubChem (CID 154971742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).