2-(2-cyclopentyl-2-fluoropropyl)pyrrolidine

C12H22FN — CID 105452441

IUPAC2-(2-cyclopentyl-2-fluoropropyl)pyrrolidine
SMILESCC(F)(CC1CCCN1)C1CCCC1
InChIInChI=1S/C12H22FN/c1-12(13,10-5-2-3-6-10)9-11-7-4-8-14-11/h10-11,14H,2-9H2,1H3
InChIKeyGMTZLAFKMIATHK-UHFFFAOYSA-N
MW199.31 g/mol
LogP3.05
Rot. Bonds3

About 2-(2-cyclopentyl-2-fluoropropyl)pyrrolidine

2-(2-cyclopentyl-2-fluoropropyl)pyrrolidine (PubChem CID 105452441) has the molecular formula C12H22FN and a molecular weight of 199.31 g/mol. Its IUPAC name is 2-(2-cyclopentyl-2-fluoropropyl)pyrrolidine.

Molecular Properties

Compound Name2-(2-cyclopentyl-2-fluoropropyl)pyrrolidine
PubChem CID105452441
Molecular FormulaC12H22FN
Molecular Weight199.31 g/mol
Exact Mass199.17
IUPAC Name2-(2-cyclopentyl-2-fluoropropyl)pyrrolidine
SMILESCC(F)(CC1CCCN1)C1CCCC1
InChIInChI=1S/C12H22FN/c1-12(13,10-5-2-3-6-10)9-11-7-4-8-14-11/h10-11,14H,2-9H2,1H3
InChIKeyGMTZLAFKMIATHK-UHFFFAOYSA-N
XLogP3.05
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.31
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclopentyl-2-fluoropropyl)pyrrolidine?
The IUPAC name of 2-(2-cyclopentyl-2-fluoropropyl)pyrrolidine (CID 105452441) is 2-(2-cyclopentyl-2-fluoropropyl)pyrrolidine.
What is the SMILES notation for 2-(2-cyclopentyl-2-fluoropropyl)pyrrolidine?
The canonical SMILES for 2-(2-cyclopentyl-2-fluoropropyl)pyrrolidine is CC(F)(CC1CCCN1)C1CCCC1.
What is the InChIKey of 2-(2-cyclopentyl-2-fluoropropyl)pyrrolidine?
The InChIKey is GMTZLAFKMIATHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22FN/c1-12(13,10-5-2-3-6-10)9-11-7-4-8-14-11/h10-11,14H,2-9H2,1H3.
What are the key properties of 2-(2-cyclopentyl-2-fluoropropyl)pyrrolidine?
2-(2-cyclopentyl-2-fluoropropyl)pyrrolidine has a molecular weight of 199.31 g/mol, XLogP of 3.05, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclopentyl-2-fluoropropyl)pyrrolidine is sourced from PubChem (CID 105452441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).