1-(furan-2-yl)piperazine

C8H12N2O — CID 19763577

IUPAC1-(furan-2-yl)piperazine
SMILESc1coc(N2CCNCC2)c1
InChIInChI=1S/C8H12N2O/c1-2-8(11-7-1)10-5-3-9-4-6-10/h1-2,7,9H,3-6H2
InChIKeyCYNXYQWCYHOAOY-UHFFFAOYSA-N
MW152.20 g/mol
LogP0.69
Rot. Bonds1

About 1-(furan-2-yl)piperazine

1-(furan-2-yl)piperazine (PubChem CID 19763577) has the molecular formula C8H12N2O and a molecular weight of 152.20 g/mol. Its IUPAC name is 1-(furan-2-yl)piperazine.

Molecular Properties

Compound Name1-(furan-2-yl)piperazine
PubChem CID19763577
Molecular FormulaC8H12N2O
Molecular Weight152.20 g/mol
Exact Mass152.09
IUPAC Name1-(furan-2-yl)piperazine
SMILESc1coc(N2CCNCC2)c1
InChIInChI=1S/C8H12N2O/c1-2-8(11-7-1)10-5-3-9-4-6-10/h1-2,7,9H,3-6H2
InChIKeyCYNXYQWCYHOAOY-UHFFFAOYSA-N
XLogP0.69
TPSA28.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-yl)piperazine?
The IUPAC name of 1-(furan-2-yl)piperazine (CID 19763577) is 1-(furan-2-yl)piperazine.
What is the SMILES notation for 1-(furan-2-yl)piperazine?
The canonical SMILES for 1-(furan-2-yl)piperazine is c1coc(N2CCNCC2)c1.
What is the InChIKey of 1-(furan-2-yl)piperazine?
The InChIKey is CYNXYQWCYHOAOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O/c1-2-8(11-7-1)10-5-3-9-4-6-10/h1-2,7,9H,3-6H2.
What are the key properties of 1-(furan-2-yl)piperazine?
1-(furan-2-yl)piperazine has a molecular weight of 152.20 g/mol, XLogP of 0.69, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-yl)piperazine is sourced from PubChem (CID 19763577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).