1-(1-benzofuran-5-yl)piperazine

C12H14N2O — CID 11030890

IUPAC1-(1-benzofuran-5-yl)piperazine
SMILESc1cc2cc(N3CCNCC3)ccc2o1
InChIInChI=1S/C12H14N2O/c1-2-12-10(3-8-15-12)9-11(1)14-6-4-13-5-7-14/h1-3,8-9,13H,4-7H2
InChIKeyPYUFUUDEYQJLPV-UHFFFAOYSA-N
MW202.26 g/mol
LogP1.84
Rot. Bonds1

About 1-(1-benzofuran-5-yl)piperazine

1-(1-benzofuran-5-yl)piperazine (PubChem CID 11030890) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is 1-(1-benzofuran-5-yl)piperazine.

Molecular Properties

Compound Name1-(1-benzofuran-5-yl)piperazine
PubChem CID11030890
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC Name1-(1-benzofuran-5-yl)piperazine
SMILESc1cc2cc(N3CCNCC3)ccc2o1
InChIInChI=1S/C12H14N2O/c1-2-12-10(3-8-15-12)9-11(1)14-6-4-13-5-7-14/h1-3,8-9,13H,4-7H2
InChIKeyPYUFUUDEYQJLPV-UHFFFAOYSA-N
XLogP1.84
TPSA28.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(1-benzofuran-5-yl)piperazine?
The IUPAC name of 1-(1-benzofuran-5-yl)piperazine (CID 11030890) is 1-(1-benzofuran-5-yl)piperazine.
What is the SMILES notation for 1-(1-benzofuran-5-yl)piperazine?
The canonical SMILES for 1-(1-benzofuran-5-yl)piperazine is c1cc2cc(N3CCNCC3)ccc2o1.
What is the InChIKey of 1-(1-benzofuran-5-yl)piperazine?
The InChIKey is PYUFUUDEYQJLPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-2-12-10(3-8-15-12)9-11(1)14-6-4-13-5-7-14/h1-3,8-9,13H,4-7H2.
What are the key properties of 1-(1-benzofuran-5-yl)piperazine?
1-(1-benzofuran-5-yl)piperazine has a molecular weight of 202.26 g/mol, XLogP of 1.84, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-benzofuran-5-yl)piperazine is sourced from PubChem (CID 11030890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).