1-(2,3-dihydrofuran-5-yl)-2-piperidin-4-ylethanone

C11H17NO2 — CID 102652436

IUPAC1-(2,3-dihydrofuran-5-yl)-2-piperidin-4-ylethanone
SMILESO=C(CC1CCNCC1)C1=CCCO1
InChIInChI=1S/C11H17NO2/c13-10(11-2-1-7-14-11)8-9-3-5-12-6-4-9/h2,9,12H,1,3-8H2
InChIKeyFGOQCRBMBJSJTN-UHFFFAOYSA-N
MW195.26 g/mol
LogP1.25
Rot. Bonds3

About 1-(2,3-dihydrofuran-5-yl)-2-piperidin-4-ylethanone

1-(2,3-dihydrofuran-5-yl)-2-piperidin-4-ylethanone (PubChem CID 102652436) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is 1-(2,3-dihydrofuran-5-yl)-2-piperidin-4-ylethanone.

Molecular Properties

Compound Name1-(2,3-dihydrofuran-5-yl)-2-piperidin-4-ylethanone
PubChem CID102652436
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC Name1-(2,3-dihydrofuran-5-yl)-2-piperidin-4-ylethanone
SMILESO=C(CC1CCNCC1)C1=CCCO1
InChIInChI=1S/C11H17NO2/c13-10(11-2-1-7-14-11)8-9-3-5-12-6-4-9/h2,9,12H,1,3-8H2
InChIKeyFGOQCRBMBJSJTN-UHFFFAOYSA-N
XLogP1.25
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydrofuran-5-yl)-2-piperidin-4-ylethanone?
The IUPAC name of 1-(2,3-dihydrofuran-5-yl)-2-piperidin-4-ylethanone (CID 102652436) is 1-(2,3-dihydrofuran-5-yl)-2-piperidin-4-ylethanone.
What is the SMILES notation for 1-(2,3-dihydrofuran-5-yl)-2-piperidin-4-ylethanone?
The canonical SMILES for 1-(2,3-dihydrofuran-5-yl)-2-piperidin-4-ylethanone is O=C(CC1CCNCC1)C1=CCCO1.
What is the InChIKey of 1-(2,3-dihydrofuran-5-yl)-2-piperidin-4-ylethanone?
The InChIKey is FGOQCRBMBJSJTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c13-10(11-2-1-7-14-11)8-9-3-5-12-6-4-9/h2,9,12H,1,3-8H2.
What are the key properties of 1-(2,3-dihydrofuran-5-yl)-2-piperidin-4-ylethanone?
1-(2,3-dihydrofuran-5-yl)-2-piperidin-4-ylethanone has a molecular weight of 195.26 g/mol, XLogP of 1.25, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydrofuran-5-yl)-2-piperidin-4-ylethanone is sourced from PubChem (CID 102652436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).