4-fluoro-1-(2-pyrrolidin-1-ylethyl)piperidine

C11H21FN2 — CID 66580302

IUPAC4-fluoro-1-(2-pyrrolidin-1-ylethyl)piperidine
SMILESFC1CCN(CCN2CCCC2)CC1
InChIInChI=1S/C11H21FN2/c12-11-3-7-14(8-4-11)10-9-13-5-1-2-6-13/h11H,1-10H2
InChIKeyJXWFDRRUWHHGIS-UHFFFAOYSA-N
MW200.30 g/mol
LogP1.52
Rot. Bonds3

About 4-fluoro-1-(2-pyrrolidin-1-ylethyl)piperidine

4-fluoro-1-(2-pyrrolidin-1-ylethyl)piperidine (PubChem CID 66580302) has the molecular formula C11H21FN2 and a molecular weight of 200.30 g/mol. Its IUPAC name is 4-fluoro-1-(2-pyrrolidin-1-ylethyl)piperidine.

Molecular Properties

Compound Name4-fluoro-1-(2-pyrrolidin-1-ylethyl)piperidine
PubChem CID66580302
Molecular FormulaC11H21FN2
Molecular Weight200.30 g/mol
Exact Mass200.17
IUPAC Name4-fluoro-1-(2-pyrrolidin-1-ylethyl)piperidine
SMILESFC1CCN(CCN2CCCC2)CC1
InChIInChI=1S/C11H21FN2/c12-11-3-7-14(8-4-11)10-9-13-5-1-2-6-13/h11H,1-10H2
InChIKeyJXWFDRRUWHHGIS-UHFFFAOYSA-N
XLogP1.52
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.30
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-1-(2-pyrrolidin-1-ylethyl)piperidine?
The IUPAC name of 4-fluoro-1-(2-pyrrolidin-1-ylethyl)piperidine (CID 66580302) is 4-fluoro-1-(2-pyrrolidin-1-ylethyl)piperidine.
What is the SMILES notation for 4-fluoro-1-(2-pyrrolidin-1-ylethyl)piperidine?
The canonical SMILES for 4-fluoro-1-(2-pyrrolidin-1-ylethyl)piperidine is FC1CCN(CCN2CCCC2)CC1.
What is the InChIKey of 4-fluoro-1-(2-pyrrolidin-1-ylethyl)piperidine?
The InChIKey is JXWFDRRUWHHGIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21FN2/c12-11-3-7-14(8-4-11)10-9-13-5-1-2-6-13/h11H,1-10H2.
What are the key properties of 4-fluoro-1-(2-pyrrolidin-1-ylethyl)piperidine?
4-fluoro-1-(2-pyrrolidin-1-ylethyl)piperidine has a molecular weight of 200.30 g/mol, XLogP of 1.52, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-1-(2-pyrrolidin-1-ylethyl)piperidine is sourced from PubChem (CID 66580302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).