3-(1-cyclopropyl-1-fluoroethyl)piperidine

C10H18FN — CID 112564879

IUPAC3-(1-cyclopropyl-1-fluoroethyl)piperidine
SMILESCC(F)(C1CC1)C1CCCNC1
InChIInChI=1S/C10H18FN/c1-10(11,8-4-5-8)9-3-2-6-12-7-9/h8-9,12H,2-7H2,1H3
InChIKeyUOVYWDLAFRZRIT-UHFFFAOYSA-N
MW171.26 g/mol
LogP2.12
Rot. Bonds2

About 3-(1-cyclopropyl-1-fluoroethyl)piperidine

3-(1-cyclopropyl-1-fluoroethyl)piperidine (PubChem CID 112564879) has the molecular formula C10H18FN and a molecular weight of 171.26 g/mol. Its IUPAC name is 3-(1-cyclopropyl-1-fluoroethyl)piperidine.

Molecular Properties

Compound Name3-(1-cyclopropyl-1-fluoroethyl)piperidine
PubChem CID112564879
Molecular FormulaC10H18FN
Molecular Weight171.26 g/mol
Exact Mass171.14
IUPAC Name3-(1-cyclopropyl-1-fluoroethyl)piperidine
SMILESCC(F)(C1CC1)C1CCCNC1
InChIInChI=1S/C10H18FN/c1-10(11,8-4-5-8)9-3-2-6-12-7-9/h8-9,12H,2-7H2,1H3
InChIKeyUOVYWDLAFRZRIT-UHFFFAOYSA-N
XLogP2.12
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.26
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(1-fluoro-1-piperidin-3-ylethyl)piperidine
CID 112565009
(3R)-3-tert-butylpiperidine
CID 59772800
(2R)-2-fluoro-2-[(3S)-piperidin-3-yl]propan-1-ol
CID 171842824
2-fluoro-2-piperidin-3-ylpropan-1-amine
CID 105431462
3-(2-fluorobut-3-en-2-yl)piperidine
CID 112564785
3-[cyclobutyl(difluoro)methyl]piperidine
CID 105443675
3-(1,1-difluoro-2-methylpropyl)piperidine
CID 83855168
3-(1,1-difluoropropyl)piperidine;hydrochloride
CID 115058466
3-(2-fluoro-1-methoxypropan-2-yl)piperidine
CID 112564846
3-[1-(3,5-dimethylphenyl)-1-fluoroethyl]piperidine
CID 112564951
3-(4-ethyl-2-fluorohexan-2-yl)piperidine
CID 112564814
1-(1-fluoro-1-piperidin-3-ylethyl)-2,3-dihydro-1H-isoindole
CID 112564983

Frequently Asked Questions

What is the IUPAC name of 3-(1-cyclopropyl-1-fluoroethyl)piperidine?
The IUPAC name of 3-(1-cyclopropyl-1-fluoroethyl)piperidine (CID 112564879) is 3-(1-cyclopropyl-1-fluoroethyl)piperidine.
What is the SMILES notation for 3-(1-cyclopropyl-1-fluoroethyl)piperidine?
The canonical SMILES for 3-(1-cyclopropyl-1-fluoroethyl)piperidine is CC(F)(C1CC1)C1CCCNC1.
What is the InChIKey of 3-(1-cyclopropyl-1-fluoroethyl)piperidine?
The InChIKey is UOVYWDLAFRZRIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18FN/c1-10(11,8-4-5-8)9-3-2-6-12-7-9/h8-9,12H,2-7H2,1H3.
What are the key properties of 3-(1-cyclopropyl-1-fluoroethyl)piperidine?
3-(1-cyclopropyl-1-fluoroethyl)piperidine has a molecular weight of 171.26 g/mol, XLogP of 2.12, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-cyclopropyl-1-fluoroethyl)piperidine is sourced from PubChem (CID 112564879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).