2-(1-butanoylpiperidin-2-yl)cyclopentan-1-one

C14H23NO2 — CID 79545289

IUPAC2-(1-butanoylpiperidin-2-yl)cyclopentan-1-one
SMILESCCCC(=O)N1CCCCC1C1CCCC1=O
InChIInChI=1S/C14H23NO2/c1-2-6-14(17)15-10-4-3-8-12(15)11-7-5-9-13(11)16/h11-12H,2-10H2,1H3
InChIKeyKVYYJGLOSJLQBZ-UHFFFAOYSA-N
MW237.34 g/mol
LogP2.54
Rot. Bonds3

About 2-(1-butanoylpiperidin-2-yl)cyclopentan-1-one

2-(1-butanoylpiperidin-2-yl)cyclopentan-1-one (PubChem CID 79545289) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is 2-(1-butanoylpiperidin-2-yl)cyclopentan-1-one.

Molecular Properties

Compound Name2-(1-butanoylpiperidin-2-yl)cyclopentan-1-one
PubChem CID79545289
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC Name2-(1-butanoylpiperidin-2-yl)cyclopentan-1-one
SMILESCCCC(=O)N1CCCCC1C1CCCC1=O
InChIInChI=1S/C14H23NO2/c1-2-6-14(17)15-10-4-3-8-12(15)11-7-5-9-13(11)16/h11-12H,2-10H2,1H3
InChIKeyKVYYJGLOSJLQBZ-UHFFFAOYSA-N
XLogP2.54
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.34
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(1-hexanoylpiperidin-2-yl)cyclohexan-1-one
CID 79553408
2-(1-octanoylpyrrolidin-2-yl)cyclopentan-1-one
CID 79548429
2-[1-(2-methylsulfanylacetyl)piperidin-2-yl]cyclopentan-1-one
CID 79544925
2-(1-octanoylpyrrolidin-2-yl)cyclohexan-1-one
CID 79539477
2-[1-(3-methylsulfanylpropanoyl)pyrrolidin-2-yl]cyclopentan-1-one
CID 79547559
2-[1-(3-methoxy-3-methylbutanoyl)piperidin-2-yl]cyclopentan-1-one
CID 103020598
2-[1-(3-cyclopentylpropanoyl)pyrrolidin-2-yl]cyclohexan-1-one
CID 79539486
2-[1-[2-(1-methoxycyclobutyl)acetyl]piperidin-2-yl]cyclopentan-1-one
CID 103556715
2-[1-(2-cyclobutylacetyl)piperidin-2-yl]cyclohexan-1-one
CID 103163775
N-ethyl-N-methyl-2-(2-oxocyclohexyl)piperidine-1-carboxamide
CID 79553640
(2S)-2-[(2R)-1-(2-cyclobutylacetyl)azepan-2-yl]cyclohexan-1-one
CID 124887668
2-methylpropyl 2-(2-oxocyclopentyl)piperidine-1-carboxylate
CID 79544850

Frequently Asked Questions

What is the IUPAC name of 2-(1-butanoylpiperidin-2-yl)cyclopentan-1-one?
The IUPAC name of 2-(1-butanoylpiperidin-2-yl)cyclopentan-1-one (CID 79545289) is 2-(1-butanoylpiperidin-2-yl)cyclopentan-1-one.
What is the SMILES notation for 2-(1-butanoylpiperidin-2-yl)cyclopentan-1-one?
The canonical SMILES for 2-(1-butanoylpiperidin-2-yl)cyclopentan-1-one is CCCC(=O)N1CCCCC1C1CCCC1=O.
What is the InChIKey of 2-(1-butanoylpiperidin-2-yl)cyclopentan-1-one?
The InChIKey is KVYYJGLOSJLQBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2/c1-2-6-14(17)15-10-4-3-8-12(15)11-7-5-9-13(11)16/h11-12H,2-10H2,1H3.
What are the key properties of 2-(1-butanoylpiperidin-2-yl)cyclopentan-1-one?
2-(1-butanoylpiperidin-2-yl)cyclopentan-1-one has a molecular weight of 237.34 g/mol, XLogP of 2.54, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-butanoylpiperidin-2-yl)cyclopentan-1-one is sourced from PubChem (CID 79545289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).