4-[4-(furan-2-yl)phenyl]piperazin-2-one

C14H14N2O2 — CID 168526951

IUPAC4-[4-(furan-2-yl)phenyl]piperazin-2-one
SMILESO=C1CN(c2ccc(-c3ccco3)cc2)CCN1
InChIInChI=1S/C14H14N2O2/c17-14-10-16(8-7-15-14)12-5-3-11(4-6-12)13-2-1-9-18-13/h1-6,9H,7-8,10H2,(H,15,17)
InChIKeyOMOOLZLMMXVFRG-UHFFFAOYSA-N
MW242.28 g/mol
LogP1.88
Rot. Bonds2

About 4-[4-(furan-2-yl)phenyl]piperazin-2-one

4-[4-(furan-2-yl)phenyl]piperazin-2-one (PubChem CID 168526951) has the molecular formula C14H14N2O2 and a molecular weight of 242.28 g/mol. Its IUPAC name is 4-[4-(furan-2-yl)phenyl]piperazin-2-one.

Molecular Properties

Compound Name4-[4-(furan-2-yl)phenyl]piperazin-2-one
PubChem CID168526951
Molecular FormulaC14H14N2O2
Molecular Weight242.28 g/mol
Exact Mass242.11
IUPAC Name4-[4-(furan-2-yl)phenyl]piperazin-2-one
SMILESO=C1CN(c2ccc(-c3ccco3)cc2)CCN1
InChIInChI=1S/C14H14N2O2/c17-14-10-16(8-7-15-14)12-5-3-11(4-6-12)13-2-1-9-18-13/h1-6,9H,7-8,10H2,(H,15,17)
InChIKeyOMOOLZLMMXVFRG-UHFFFAOYSA-N
XLogP1.88
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(furan-2-ylmethyl)-3-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]urea
CID 38285248
4-(4-ethylphenyl)piperazin-2-one
CID 117005105
2-(furan-2-yl)-N-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]quinoline-4-carboxamide
CID 46443064
1-[4-(furan-2-yl)phenyl]pyrrolidine-2,5-dione
CID 168527054
4-[4-(2-aminoethyl)phenyl]piperazin-2-one
CID 83822156
1-(furan-2-carbonyl)-N-[4-(3-oxopiperazin-1-yl)phenyl]piperidine-4-carboxamide
CID 46467939
1-methyl-N-[4-(3-oxopiperazin-1-yl)phenyl]pyrrole-2-carboxamide
CID 78875733
4-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazin-2-one
CID 117005141
2-[2-amino-5-(furan-2-yl)phenyl]-1-(4-piperazin-1-ylphenyl)ethanone
CID 148807592
N-[3-[[[4-(3-oxopiperazin-1-yl)phenyl]methylcarbamoylamino]methyl]phenyl]furan-2-carboxamide
CID 38314914
4-(furan-2-carbonyl)-N'-methyl-N-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]piperazine-1-carboximidamide;hydroiodide
CID 111167040
4-(4-pyrrolidin-2-ylphenyl)piperazin-2-one
CID 117365564

Frequently Asked Questions

What is the IUPAC name of 4-[4-(furan-2-yl)phenyl]piperazin-2-one?
The IUPAC name of 4-[4-(furan-2-yl)phenyl]piperazin-2-one (CID 168526951) is 4-[4-(furan-2-yl)phenyl]piperazin-2-one.
What is the SMILES notation for 4-[4-(furan-2-yl)phenyl]piperazin-2-one?
The canonical SMILES for 4-[4-(furan-2-yl)phenyl]piperazin-2-one is O=C1CN(c2ccc(-c3ccco3)cc2)CCN1.
What is the InChIKey of 4-[4-(furan-2-yl)phenyl]piperazin-2-one?
The InChIKey is OMOOLZLMMXVFRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2/c17-14-10-16(8-7-15-14)12-5-3-11(4-6-12)13-2-1-9-18-13/h1-6,9H,7-8,10H2,(H,15,17).
What are the key properties of 4-[4-(furan-2-yl)phenyl]piperazin-2-one?
4-[4-(furan-2-yl)phenyl]piperazin-2-one has a molecular weight of 242.28 g/mol, XLogP of 1.88, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(furan-2-yl)phenyl]piperazin-2-one is sourced from PubChem (CID 168526951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).