1-(2,3-dihydrofuran-5-yl)-2-piperazin-1-ylethanone

C10H16N2O2 — CID 102652434

IUPAC1-(2,3-dihydrofuran-5-yl)-2-piperazin-1-ylethanone
SMILESO=C(CN1CCNCC1)C1=CCCO1
InChIInChI=1S/C10H16N2O2/c13-9(10-2-1-7-14-10)8-12-5-3-11-4-6-12/h2,11H,1,3-8H2
InChIKeyOITXDOGTMMAANX-UHFFFAOYSA-N
MW196.25 g/mol
LogP-0.24
Rot. Bonds3

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

1-(2,3-dihydrofuran-5-yl)-2-piperazin-1-ylethanone (PubChem CID 102652434) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 1-(2,3-dihydrofuran-5-yl)-2-piperazin-1-ylethanone.

Molecular Properties

Compound Name1-(2,3-dihydrofuran-5-yl)-2-piperazin-1-ylethanone
PubChem CID102652434
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name1-(2,3-dihydrofuran-5-yl)-2-piperazin-1-ylethanone
SMILESO=C(CN1CCNCC1)C1=CCCO1
InChIInChI=1S/C10H16N2O2/c13-9(10-2-1-7-14-10)8-12-5-3-11-4-6-12/h2,11H,1,3-8H2
InChIKeyOITXDOGTMMAANX-UHFFFAOYSA-N
XLogP-0.24
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 5-0.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydrofuran-5-yl)-2-piperazin-1-ylethanone?
The IUPAC name of 1-(2,3-dihydrofuran-5-yl)-2-piperazin-1-ylethanone (CID 102652434) is 1-(2,3-dihydrofuran-5-yl)-2-piperazin-1-ylethanone.
What is the SMILES notation for 1-(2,3-dihydrofuran-5-yl)-2-piperazin-1-ylethanone?
The canonical SMILES for 1-(2,3-dihydrofuran-5-yl)-2-piperazin-1-ylethanone is O=C(CN1CCNCC1)C1=CCCO1.
What is the InChIKey of 1-(2,3-dihydrofuran-5-yl)-2-piperazin-1-ylethanone?
The InChIKey is OITXDOGTMMAANX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c13-9(10-2-1-7-14-10)8-12-5-3-11-4-6-12/h2,11H,1,3-8H2.
What are the key properties of 1-(2,3-dihydrofuran-5-yl)-2-piperazin-1-ylethanone?
1-(2,3-dihydrofuran-5-yl)-2-piperazin-1-ylethanone has a molecular weight of 196.25 g/mol, XLogP of -0.24, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydrofuran-5-yl)-2-piperazin-1-ylethanone is sourced from PubChem (CID 102652434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).