1-(3-cyclopentylpiperidin-1-yl)ethanone

C12H21NO — CID 91592675

IUPAC1-(3-cyclopentylpiperidin-1-yl)ethanone
SMILESCC(=O)N1CCCC(C2CCCC2)C1
InChIInChI=1S/C12H21NO/c1-10(14)13-8-4-7-12(9-13)11-5-2-3-6-11/h11-12H,2-9H2,1H3
InChIKeyTTYXCTAWJSOABA-UHFFFAOYSA-N
MW195.31 g/mol
LogP2.44
Rot. Bonds1

About 1-(3-cyclopentylpiperidin-1-yl)ethanone

1-(3-cyclopentylpiperidin-1-yl)ethanone (PubChem CID 91592675) has the molecular formula C12H21NO and a molecular weight of 195.31 g/mol. Its IUPAC name is 1-(3-cyclopentylpiperidin-1-yl)ethanone.

Molecular Properties

Compound Name1-(3-cyclopentylpiperidin-1-yl)ethanone
PubChem CID91592675
Molecular FormulaC12H21NO
Molecular Weight195.31 g/mol
Exact Mass195.16
IUPAC Name1-(3-cyclopentylpiperidin-1-yl)ethanone
SMILESCC(=O)N1CCCC(C2CCCC2)C1
InChIInChI=1S/C12H21NO/c1-10(14)13-8-4-7-12(9-13)11-5-2-3-6-11/h11-12H,2-9H2,1H3
InChIKeyTTYXCTAWJSOABA-UHFFFAOYSA-N
XLogP2.44
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]ethanone
CID 126758675
1-[3-(azetidin-3-yl)piperidin-1-yl]ethanone
CID 166469294
ethane;1-[(3R)-3-methylpiperidin-1-yl]ethanone
CID 176561282
ethane;1-(3-methylpiperidin-1-yl)ethanone
CID 91356589
1-(3-hydroxypiperidin-1-yl)ethanone;methanethiol
CID 143678194
1-acetylpiperidine-3-carboxylic acid
CID 14043896
1-(1-methyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridin-6-yl)ethanone
CID 73102563
ethane;N-methylmethanamine;1-(3-methylpiperidin-1-yl)ethanone
CID 142926583
1-[4-(1-acetylpiperidine-3-carbonyl)piperazin-1-yl]ethanone
CID 110686076
1-acetylpiperidine-3-carboxylic acid;ethane
CID 143204854
(3S)-1-acetylpiperidine-3-carboxylate
CID 7131083
1-[(3S)-3-(methylamino)piperidin-1-yl]ethanone;hydrochloride
CID 172646124

Frequently Asked Questions

What is the IUPAC name of 1-(3-cyclopentylpiperidin-1-yl)ethanone?
The IUPAC name of 1-(3-cyclopentylpiperidin-1-yl)ethanone (CID 91592675) is 1-(3-cyclopentylpiperidin-1-yl)ethanone.
What is the SMILES notation for 1-(3-cyclopentylpiperidin-1-yl)ethanone?
The canonical SMILES for 1-(3-cyclopentylpiperidin-1-yl)ethanone is CC(=O)N1CCCC(C2CCCC2)C1.
What is the InChIKey of 1-(3-cyclopentylpiperidin-1-yl)ethanone?
The InChIKey is TTYXCTAWJSOABA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO/c1-10(14)13-8-4-7-12(9-13)11-5-2-3-6-11/h11-12H,2-9H2,1H3.
What are the key properties of 1-(3-cyclopentylpiperidin-1-yl)ethanone?
1-(3-cyclopentylpiperidin-1-yl)ethanone has a molecular weight of 195.31 g/mol, XLogP of 2.44, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-cyclopentylpiperidin-1-yl)ethanone is sourced from PubChem (CID 91592675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).