3-[2-(2-bicyclo[2.2.1]heptanyl)-1-fluoroethyl]piperidine

C14H24FN — CID 112565377

IUPAC3-[2-(2-bicyclo[2.2.1]heptanyl)-1-fluoroethyl]piperidine
SMILESFC(CC1CC2CCC1C2)C1CCCNC1
InChIInChI=1S/C14H24FN/c15-14(12-2-1-5-16-9-12)8-13-7-10-3-4-11(13)6-10/h10-14,16H,1-9H2
InChIKeyBEESLJCZSBMTDF-UHFFFAOYSA-N
MW225.35 g/mol
LogP3.15
Rot. Bonds3

About 3-[2-(2-bicyclo[2.2.1]heptanyl)-1-fluoroethyl]piperidine

3-[2-(2-bicyclo[2.2.1]heptanyl)-1-fluoroethyl]piperidine (PubChem CID 112565377) has the molecular formula C14H24FN and a molecular weight of 225.35 g/mol. Its IUPAC name is 3-[2-(2-bicyclo[2.2.1]heptanyl)-1-fluoroethyl]piperidine.

Molecular Properties

Compound Name3-[2-(2-bicyclo[2.2.1]heptanyl)-1-fluoroethyl]piperidine
PubChem CID112565377
Molecular FormulaC14H24FN
Molecular Weight225.35 g/mol
Exact Mass225.19
IUPAC Name3-[2-(2-bicyclo[2.2.1]heptanyl)-1-fluoroethyl]piperidine
SMILESFC(CC1CC2CCC1C2)C1CCCNC1
InChIInChI=1S/C14H24FN/c15-14(12-2-1-5-16-9-12)8-13-7-10-3-4-11(13)6-10/h10-14,16H,1-9H2
InChIKeyBEESLJCZSBMTDF-UHFFFAOYSA-N
XLogP3.15
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.35
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-bicyclo[2.2.1]heptanyl)-1-cyclopentylethanamine
CID 79559439
2-(2-bicyclo[2.2.1]heptanyl)-1-cyclobutylethanamine
CID 79562076
3-(2-bicyclo[2.2.1]heptanyl)-1,1-difluoropropan-2-amine
CID 103516898
3-(2-bicyclo[2.2.1]heptanyl)-2-fluoropropan-1-amine
CID 112562649
(3S)-3-[(1S)-1-fluoroethyl]piperidine
CID 124547553
2-(2-bicyclo[2.2.1]heptanyl)-1-cyclopropylethanol
CID 79557935
3-[cyclobutyl(fluoro)methyl]piperidine;hydrochloride
CID 115058477
2-(2-bicyclo[2.2.1]heptanyl)-1-(6-bicyclo[3.1.0]hexanyl)ethanol
CID 115821223
2-(2-bicyclo[2.2.1]heptanyl)-1-(oxan-3-yl)ethanamine
CID 79562690
2-(2-bicyclo[2.2.1]heptanyl)-1-cyclooctyl-N-ethylethanamine
CID 80603053
3-(2-bicyclo[2.2.1]heptanylmethyl)-3-fluoropiperidine
CID 112562902
2-(2-bicyclo[2.2.1]heptanyl)-N-(piperidin-3-ylmethyl)-N-propan-2-ylacetamide
CID 106628941

Frequently Asked Questions

What is the IUPAC name of 3-[2-(2-bicyclo[2.2.1]heptanyl)-1-fluoroethyl]piperidine?
The IUPAC name of 3-[2-(2-bicyclo[2.2.1]heptanyl)-1-fluoroethyl]piperidine (CID 112565377) is 3-[2-(2-bicyclo[2.2.1]heptanyl)-1-fluoroethyl]piperidine.
What is the SMILES notation for 3-[2-(2-bicyclo[2.2.1]heptanyl)-1-fluoroethyl]piperidine?
The canonical SMILES for 3-[2-(2-bicyclo[2.2.1]heptanyl)-1-fluoroethyl]piperidine is FC(CC1CC2CCC1C2)C1CCCNC1.
What is the InChIKey of 3-[2-(2-bicyclo[2.2.1]heptanyl)-1-fluoroethyl]piperidine?
The InChIKey is BEESLJCZSBMTDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24FN/c15-14(12-2-1-5-16-9-12)8-13-7-10-3-4-11(13)6-10/h10-14,16H,1-9H2.
What are the key properties of 3-[2-(2-bicyclo[2.2.1]heptanyl)-1-fluoroethyl]piperidine?
3-[2-(2-bicyclo[2.2.1]heptanyl)-1-fluoroethyl]piperidine has a molecular weight of 225.35 g/mol, XLogP of 3.15, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(2-bicyclo[2.2.1]heptanyl)-1-fluoroethyl]piperidine is sourced from PubChem (CID 112565377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).