2-[(3-fluoropyrrolidin-1-yl)methyl]piperidine

C10H19FN2 — CID 23190311

IUPAC2-[(3-fluoropyrrolidin-1-yl)methyl]piperidine
SMILESFC1CCN(CC2CCCCN2)C1
InChIInChI=1S/C10H19FN2/c11-9-4-6-13(7-9)8-10-3-1-2-5-12-10/h9-10,12H,1-8H2
InChIKeyKCERPRDFPWGQNX-UHFFFAOYSA-N
MW186.27 g/mol
LogP1.17
Rot. Bonds2

About 2-[(3-fluoropyrrolidin-1-yl)methyl]piperidine

2-[(3-fluoropyrrolidin-1-yl)methyl]piperidine (PubChem CID 23190311) has the molecular formula C10H19FN2 and a molecular weight of 186.27 g/mol. Its IUPAC name is 2-[(3-fluoropyrrolidin-1-yl)methyl]piperidine.

Molecular Properties

Compound Name2-[(3-fluoropyrrolidin-1-yl)methyl]piperidine
PubChem CID23190311
Molecular FormulaC10H19FN2
Molecular Weight186.27 g/mol
Exact Mass186.15
IUPAC Name2-[(3-fluoropyrrolidin-1-yl)methyl]piperidine
SMILESFC1CCN(CC2CCCCN2)C1
InChIInChI=1S/C10H19FN2/c11-9-4-6-13(7-9)8-10-3-1-2-5-12-10/h9-10,12H,1-8H2
InChIKeyKCERPRDFPWGQNX-UHFFFAOYSA-N
XLogP1.17
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.27
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(3-fluoropyrrolidin-1-yl)methyl]piperidine?
The IUPAC name of 2-[(3-fluoropyrrolidin-1-yl)methyl]piperidine (CID 23190311) is 2-[(3-fluoropyrrolidin-1-yl)methyl]piperidine.
What is the SMILES notation for 2-[(3-fluoropyrrolidin-1-yl)methyl]piperidine?
The canonical SMILES for 2-[(3-fluoropyrrolidin-1-yl)methyl]piperidine is FC1CCN(CC2CCCCN2)C1.
What is the InChIKey of 2-[(3-fluoropyrrolidin-1-yl)methyl]piperidine?
The InChIKey is KCERPRDFPWGQNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19FN2/c11-9-4-6-13(7-9)8-10-3-1-2-5-12-10/h9-10,12H,1-8H2.
What are the key properties of 2-[(3-fluoropyrrolidin-1-yl)methyl]piperidine?
2-[(3-fluoropyrrolidin-1-yl)methyl]piperidine has a molecular weight of 186.27 g/mol, XLogP of 1.17, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-fluoropyrrolidin-1-yl)methyl]piperidine is sourced from PubChem (CID 23190311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).