1-(2,4-difluorophenyl)-4-thiophen-3-ylpiperazine

C14H14F2N2S — CID 69278616

IUPAC1-(2,4-difluorophenyl)-4-thiophen-3-ylpiperazine
SMILESFc1ccc(N2CCN(c3ccsc3)CC2)c(F)c1
InChIInChI=1S/C14H14F2N2S/c15-11-1-2-14(13(16)9-11)18-6-4-17(5-7-18)12-3-8-19-10-12/h1-3,8-10H,4-7H2
InChIKeyQGWBBXXSGIRESH-UHFFFAOYSA-N
MW280.34 g/mol
LogP3.35
Rot. Bonds2

About 1-(2,4-difluorophenyl)-4-thiophen-3-ylpiperazine

1-(2,4-difluorophenyl)-4-thiophen-3-ylpiperazine (PubChem CID 69278616) has the molecular formula C14H14F2N2S and a molecular weight of 280.34 g/mol. Its IUPAC name is 1-(2,4-difluorophenyl)-4-thiophen-3-ylpiperazine.

Molecular Properties

Compound Name1-(2,4-difluorophenyl)-4-thiophen-3-ylpiperazine
PubChem CID69278616
Molecular FormulaC14H14F2N2S
Molecular Weight280.34 g/mol
Exact Mass280.08
IUPAC Name1-(2,4-difluorophenyl)-4-thiophen-3-ylpiperazine
SMILESFc1ccc(N2CCN(c3ccsc3)CC2)c(F)c1
InChIInChI=1S/C14H14F2N2S/c15-11-1-2-14(13(16)9-11)18-6-4-17(5-7-18)12-3-8-19-10-12/h1-3,8-10H,4-7H2
InChIKeyQGWBBXXSGIRESH-UHFFFAOYSA-N
XLogP3.35
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.34
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2,4-difluorophenyl)-4-thiophen-3-ylpiperazine?
The IUPAC name of 1-(2,4-difluorophenyl)-4-thiophen-3-ylpiperazine (CID 69278616) is 1-(2,4-difluorophenyl)-4-thiophen-3-ylpiperazine.
What is the SMILES notation for 1-(2,4-difluorophenyl)-4-thiophen-3-ylpiperazine?
The canonical SMILES for 1-(2,4-difluorophenyl)-4-thiophen-3-ylpiperazine is Fc1ccc(N2CCN(c3ccsc3)CC2)c(F)c1.
What is the InChIKey of 1-(2,4-difluorophenyl)-4-thiophen-3-ylpiperazine?
The InChIKey is QGWBBXXSGIRESH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14F2N2S/c15-11-1-2-14(13(16)9-11)18-6-4-17(5-7-18)12-3-8-19-10-12/h1-3,8-10H,4-7H2.
What are the key properties of 1-(2,4-difluorophenyl)-4-thiophen-3-ylpiperazine?
1-(2,4-difluorophenyl)-4-thiophen-3-ylpiperazine has a molecular weight of 280.34 g/mol, XLogP of 3.35, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-difluorophenyl)-4-thiophen-3-ylpiperazine is sourced from PubChem (CID 69278616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).