3-(cyclopentylmethyl)-2-fluoropiperidine

C11H20FN — CID 57031665

IUPAC3-(cyclopentylmethyl)-2-fluoropiperidine
SMILESFC1NCCCC1CC1CCCC1
InChIInChI=1S/C11H20FN/c12-11-10(6-3-7-13-11)8-9-4-1-2-5-9/h9-11,13H,1-8H2
InChIKeyUCKUYFONFQJFRD-UHFFFAOYSA-N
MW185.29 g/mol
LogP2.86
Rot. Bonds2

About 3-(cyclopentylmethyl)-2-fluoropiperidine

3-(cyclopentylmethyl)-2-fluoropiperidine (PubChem CID 57031665) has the molecular formula C11H20FN and a molecular weight of 185.29 g/mol. Its IUPAC name is 3-(cyclopentylmethyl)-2-fluoropiperidine.

Molecular Properties

Compound Name3-(cyclopentylmethyl)-2-fluoropiperidine
PubChem CID57031665
Molecular FormulaC11H20FN
Molecular Weight185.29 g/mol
Exact Mass185.16
IUPAC Name3-(cyclopentylmethyl)-2-fluoropiperidine
SMILESFC1NCCCC1CC1CCCC1
InChIInChI=1S/C11H20FN/c12-11-10(6-3-7-13-11)8-9-4-1-2-5-9/h9-11,13H,1-8H2
InChIKeyUCKUYFONFQJFRD-UHFFFAOYSA-N
XLogP2.86
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.29
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}

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Related Compounds

4-(Cyclohexylmethyl)piperidine
CID 98883
6-Azaspiro[4.5]decane
CID 22569865
4-Octylpiperidine hydrochloride
CID 24181035
2-(2-Cyclopentyl-2-cyclopropylethyl)piperidine
CID 137638044
4-Pentylpiperidine
CID 407054
2-Cyclopentylpiperidine
CID 4646584
7-Azaspiro[4.5]decane
CID 14448981
4-Cyclopentylpiperidine hydrochloride
CID 54595789
3-Hexylpiperidine hydrochloride
CID 69042465
4-(Cyclopentylmethyl)piperidine hydrochloride
CID 85723313
4-Hexylpiperidine hydrochloride
CID 86262818
4-(3-Fluoropropyl)piperidine hydrochloride
CID 137944905

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopentylmethyl)-2-fluoropiperidine?
The IUPAC name of 3-(cyclopentylmethyl)-2-fluoropiperidine (CID 57031665) is 3-(cyclopentylmethyl)-2-fluoropiperidine.
What is the SMILES notation for 3-(cyclopentylmethyl)-2-fluoropiperidine?
The canonical SMILES for 3-(cyclopentylmethyl)-2-fluoropiperidine is FC1NCCCC1CC1CCCC1.
What is the InChIKey of 3-(cyclopentylmethyl)-2-fluoropiperidine?
The InChIKey is UCKUYFONFQJFRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20FN/c12-11-10(6-3-7-13-11)8-9-4-1-2-5-9/h9-11,13H,1-8H2.
What are the key properties of 3-(cyclopentylmethyl)-2-fluoropiperidine?
3-(cyclopentylmethyl)-2-fluoropiperidine has a molecular weight of 185.29 g/mol, XLogP of 2.86, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopentylmethyl)-2-fluoropiperidine is sourced from PubChem (CID 57031665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).