(3S)-3-[(1S)-1-fluoroethyl]piperidine

C7H14FN — CID 124547553

IUPAC(3S)-3-[(1S)-1-fluoroethyl]piperidine
SMILESC[C@H](F)[C@H]1CCCNC1
InChIInChI=1S/C7H14FN/c1-6(8)7-3-2-4-9-5-7/h6-7,9H,2-5H2,1H3/t6-,7-/m0/s1
InChIKeyFRQZHLXDSMDLKQ-BQBZGAKWSA-N
MW131.19 g/mol
LogP1.34
Rot. Bonds1

About (3S)-3-[(1S)-1-fluoroethyl]piperidine

(3S)-3-[(1S)-1-fluoroethyl]piperidine (PubChem CID 124547553) has the molecular formula C7H14FN and a molecular weight of 131.19 g/mol. Its IUPAC name is (3S)-3-[(1S)-1-fluoroethyl]piperidine.

Molecular Properties

Compound Name(3S)-3-[(1S)-1-fluoroethyl]piperidine
PubChem CID124547553
Molecular FormulaC7H14FN
Molecular Weight131.19 g/mol
Exact Mass131.11
IUPAC Name(3S)-3-[(1S)-1-fluoroethyl]piperidine
SMILESC[C@H](F)[C@H]1CCCNC1
InChIInChI=1S/C7H14FN/c1-6(8)7-3-2-4-9-5-7/h6-7,9H,2-5H2,1H3/t6-,7-/m0/s1
InChIKeyFRQZHLXDSMDLKQ-BQBZGAKWSA-N
XLogP1.34
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.19
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-(1-fluoroethyl)azepane
CID 105428868
3-[cyclobutyl(fluoro)methyl]piperidine;hydrochloride
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piperidin-3-ylmethanediol
CID 5231808
3-(2-bromo-1,2,2-trifluoroethyl)piperidine
CID 107140632
4-[(1R)-1-fluoroethyl]piperidine
CID 124547551
3-(5-piperidin-4-ylhexan-2-yl)piperidine
CID 129299226
3-methyl-1-piperidin-3-ylbutan-1-amine
CID 82412260
4-(1-piperidin-3-ylethyl)phenol
CID 83908771
(3R)-3-[bis(4-fluorophenyl)methyl]piperidine
CID 166747896
3-[1-(4-fluoro-3-methoxyphenyl)ethyl]piperidine
CID 83912228
2,2-dimethyl-1-piperidin-3-ylpropan-1-amine
CID 116935763
cyclopentyl(piperidin-3-yl)methanol
CID 80560291

Frequently Asked Questions

What is the IUPAC name of (3S)-3-[(1S)-1-fluoroethyl]piperidine?
The IUPAC name of (3S)-3-[(1S)-1-fluoroethyl]piperidine (CID 124547553) is (3S)-3-[(1S)-1-fluoroethyl]piperidine.
What is the SMILES notation for (3S)-3-[(1S)-1-fluoroethyl]piperidine?
The canonical SMILES for (3S)-3-[(1S)-1-fluoroethyl]piperidine is C[C@H](F)[C@H]1CCCNC1.
What is the InChIKey of (3S)-3-[(1S)-1-fluoroethyl]piperidine?
The InChIKey is FRQZHLXDSMDLKQ-BQBZGAKWSA-N. The full InChI is InChI=1S/C7H14FN/c1-6(8)7-3-2-4-9-5-7/h6-7,9H,2-5H2,1H3/t6-,7-/m0/s1.
What are the key properties of (3S)-3-[(1S)-1-fluoroethyl]piperidine?
(3S)-3-[(1S)-1-fluoroethyl]piperidine has a molecular weight of 131.19 g/mol, XLogP of 1.34, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-[(1S)-1-fluoroethyl]piperidine is sourced from PubChem (CID 124547553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).