cyclopentyl-(3,3-difluoro-4-propan-2-yloxypiperidin-1-yl)methanone

C14H23F2NO2 — CID 162278259

IUPACcyclopentyl-(3,3-difluoro-4-propan-2-yloxypiperidin-1-yl)methanone
SMILESCC(C)OC1CCN(C(=O)C2CCCC2)CC1(F)F
InChIInChI=1S/C14H23F2NO2/c1-10(2)19-12-7-8-17(9-14(12,15)16)13(18)11-5-3-4-6-11/h10-12H,3-9H2,1-2H3
InChIKeyUODFYHZDOCSSJZ-UHFFFAOYSA-N
MW275.34 g/mol
LogP2.84
Rot. Bonds3

About cyclopentyl-(3,3-difluoro-4-propan-2-yloxypiperidin-1-yl)methanone

cyclopentyl-(3,3-difluoro-4-propan-2-yloxypiperidin-1-yl)methanone (PubChem CID 162278259) has the molecular formula C14H23F2NO2 and a molecular weight of 275.34 g/mol. Its IUPAC name is cyclopentyl-(3,3-difluoro-4-propan-2-yloxypiperidin-1-yl)methanone.

Molecular Properties

Compound Namecyclopentyl-(3,3-difluoro-4-propan-2-yloxypiperidin-1-yl)methanone
PubChem CID162278259
Molecular FormulaC14H23F2NO2
Molecular Weight275.34 g/mol
Exact Mass275.17
IUPAC Namecyclopentyl-(3,3-difluoro-4-propan-2-yloxypiperidin-1-yl)methanone
SMILESCC(C)OC1CCN(C(=O)C2CCCC2)CC1(F)F
InChIInChI=1S/C14H23F2NO2/c1-10(2)19-12-7-8-17(9-14(12,15)16)13(18)11-5-3-4-6-11/h10-12H,3-9H2,1-2H3
InChIKeyUODFYHZDOCSSJZ-UHFFFAOYSA-N
XLogP2.84
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.34
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

cyclobutyl-(4-propan-2-yloxypiperidin-1-yl)methanone
CID 110725421
cycloheptyl-(4-propan-2-ylpiperidin-1-yl)methanone
CID 155764605
[(4S)-3,3-difluoro-1-[(2S)-2-hydroxypropanoyl]piperidin-4-yl] hypoiodite
CID 121246905
cyclobutyl-(3-fluoro-3-methylazetidin-1-yl)methanone
CID 130890914
cyclooctyl-[3-(1-hydroxyethyl)pyrrolidin-1-yl]methanone
CID 112627515
[3-(1-aminoethyl)pyrrolidin-1-yl]-cyclooctylmethanone
CID 112630786
[(4R)-3,3-difluoro-4-(4-propan-2-ylpiperidin-1-yl)piperidin-1-yl]-(1-propan-2-ylazetidin-3-yl)methanone
CID 176796831
(1-methylsulfonylpiperidin-4-yl)-(4-propan-2-yloxypiperidin-1-yl)methanone
CID 110725414
[4-(azepane-1-carbonyl)piperidin-1-yl]-cyclopentylmethanone
CID 134029844
[(4S)-3,3-difluoro-4-methoxypiperidin-1-yl]-(5-methyl-1,2,4-triazolidin-3-yl)methanone
CID 139353552
3-[2-(3,3-difluoro-4-propan-2-yloxypiperidin-1-yl)propan-2-yl]-1,3-oxazinane
CID 138525344
aziridin-1-yl(cyclohexyl)methanone
CID 2309619

Frequently Asked Questions

What is the IUPAC name of cyclopentyl-(3,3-difluoro-4-propan-2-yloxypiperidin-1-yl)methanone?
The IUPAC name of cyclopentyl-(3,3-difluoro-4-propan-2-yloxypiperidin-1-yl)methanone (CID 162278259) is cyclopentyl-(3,3-difluoro-4-propan-2-yloxypiperidin-1-yl)methanone.
What is the SMILES notation for cyclopentyl-(3,3-difluoro-4-propan-2-yloxypiperidin-1-yl)methanone?
The canonical SMILES for cyclopentyl-(3,3-difluoro-4-propan-2-yloxypiperidin-1-yl)methanone is CC(C)OC1CCN(C(=O)C2CCCC2)CC1(F)F.
What is the InChIKey of cyclopentyl-(3,3-difluoro-4-propan-2-yloxypiperidin-1-yl)methanone?
The InChIKey is UODFYHZDOCSSJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23F2NO2/c1-10(2)19-12-7-8-17(9-14(12,15)16)13(18)11-5-3-4-6-11/h10-12H,3-9H2,1-2H3.
What are the key properties of cyclopentyl-(3,3-difluoro-4-propan-2-yloxypiperidin-1-yl)methanone?
cyclopentyl-(3,3-difluoro-4-propan-2-yloxypiperidin-1-yl)methanone has a molecular weight of 275.34 g/mol, XLogP of 2.84, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl-(3,3-difluoro-4-propan-2-yloxypiperidin-1-yl)methanone is sourced from PubChem (CID 162278259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).