cyclobutyl 2-piperidin-3-ylacetate

C11H19NO2 — CID 62690484

IUPACcyclobutyl 2-piperidin-3-ylacetate
SMILESO=C(CC1CCCNC1)OC1CCC1
InChIInChI=1S/C11H19NO2/c13-11(14-10-4-1-5-10)7-9-3-2-6-12-8-9/h9-10,12H,1-8H2
InChIKeyKCKLMJBRSPNSLY-UHFFFAOYSA-N
MW197.28 g/mol
LogP1.47
Rot. Bonds3

About cyclobutyl 2-piperidin-3-ylacetate

cyclobutyl 2-piperidin-3-ylacetate (PubChem CID 62690484) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is cyclobutyl 2-piperidin-3-ylacetate.

Molecular Properties

Compound Namecyclobutyl 2-piperidin-3-ylacetate
PubChem CID62690484
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Namecyclobutyl 2-piperidin-3-ylacetate
SMILESO=C(CC1CCCNC1)OC1CCC1
InChIInChI=1S/C11H19NO2/c13-11(14-10-4-1-5-10)7-9-3-2-6-12-8-9/h9-10,12H,1-8H2
InChIKeyKCKLMJBRSPNSLY-UHFFFAOYSA-N
XLogP1.47
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

cyclobutyl 3-piperidin-3-ylpropanoate
CID 62217581
methyl 2-piperidin-3-ylacetate;dihydrochloride
CID 141033576
ethyl 2-[(3S)-piperidin-3-yl]acetate
CID 7016849
cyclopentyl 2-cyclohexylacetate;hydrochloride
CID 174567498
2,2,2-trifluoroethyl 2-piperidin-3-ylacetate
CID 102548856
butan-2-yl 2-piperidin-3-ylacetate
CID 62690309
2-ethoxyethyl 2-piperidin-3-ylacetate
CID 62690313
(3-ethylcyclohexyl) 2-morpholin-2-ylacetate
CID 66433853
N-oxo-2-piperidin-3-ylacetamide
CID 163768787
2-propoxyethyl 2-piperidin-3-ylacetate
CID 63686889
(3-ethylcyclohexyl) (3R)-piperidine-3-carboxylate
CID 81121055
cyclohexyl 2-pyrrolidin-2-ylacetate
CID 61372710

Frequently Asked Questions

What is the IUPAC name of cyclobutyl 2-piperidin-3-ylacetate?
The IUPAC name of cyclobutyl 2-piperidin-3-ylacetate (CID 62690484) is cyclobutyl 2-piperidin-3-ylacetate.
What is the SMILES notation for cyclobutyl 2-piperidin-3-ylacetate?
The canonical SMILES for cyclobutyl 2-piperidin-3-ylacetate is O=C(CC1CCCNC1)OC1CCC1.
What is the InChIKey of cyclobutyl 2-piperidin-3-ylacetate?
The InChIKey is KCKLMJBRSPNSLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c13-11(14-10-4-1-5-10)7-9-3-2-6-12-8-9/h9-10,12H,1-8H2.
What are the key properties of cyclobutyl 2-piperidin-3-ylacetate?
cyclobutyl 2-piperidin-3-ylacetate has a molecular weight of 197.28 g/mol, XLogP of 1.47, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclobutyl 2-piperidin-3-ylacetate is sourced from PubChem (CID 62690484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).