1-(2,2-difluoroethyl)piperazine

C6H12F2N2 — CID 19622797

IUPAC1-(2,2-difluoroethyl)piperazine
SMILESFC(F)CN1CCNCC1
InChIInChI=1S/C6H12F2N2/c7-6(8)5-10-3-1-9-2-4-10/h6,9H,1-5H2
InChIKeyJIARBLBYLGYCBZ-UHFFFAOYSA-N
MW150.17 g/mol
LogP0.16
Rot. Bonds2

About 1-(2,2-difluoroethyl)piperazine

1-(2,2-difluoroethyl)piperazine (PubChem CID 19622797) has the molecular formula C6H12F2N2 and a molecular weight of 150.17 g/mol. Its IUPAC name is 1-(2,2-difluoroethyl)piperazine.

Molecular Properties

Compound Name1-(2,2-difluoroethyl)piperazine
PubChem CID19622797
Molecular FormulaC6H12F2N2
Molecular Weight150.17 g/mol
Exact Mass150.10
IUPAC Name1-(2,2-difluoroethyl)piperazine
SMILESFC(F)CN1CCNCC1
InChIInChI=1S/C6H12F2N2/c7-6(8)5-10-3-1-9-2-4-10/h6,9H,1-5H2
InChIKeyJIARBLBYLGYCBZ-UHFFFAOYSA-N
XLogP0.16
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.17
LogP ≤ 50.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(azetidin-3-yl)-4-(2,2-difluoroethyl)piperazine
CID 66202573
methane;1-(2-methylpropyl)piperazine
CID 167537973
(2R)-1-piperazin-1-ylbutan-2-ol;dihydrochloride
CID 178200129
1-(difluoromethoxymethyl)piperazine
CID 175602638
piperazine;1-piperazin-1-ylpropan-2-ol
CID 174899588
2-amino-1,3-di(piperazin-1-yl)propan-1-one
CID 82511538
1-[1-(1,4,7-triazonan-1-yl)propan-2-yl]-1,4,7-triazonane
CID 22495519
1-(2-cyclopropyl-3,3,3-trifluoropropyl)piperazine
CID 83838684
2-methyl-1,3-di(piperazin-1-yl)propan-1-one
CID 82511421
1-[2-(azetidin-3-yl)ethyl]-4-(2,2-difluoroethyl)piperazine;ethane
CID 145259630
1-(2,2-difluoroethyl)-7-ethyl-1,4-diazepane
CID 172843294
1-(2-methylpropyl)piperazine;2,2,2-trifluoroacetic acid
CID 118367131

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-difluoroethyl)piperazine?
The IUPAC name of 1-(2,2-difluoroethyl)piperazine (CID 19622797) is 1-(2,2-difluoroethyl)piperazine.
What is the SMILES notation for 1-(2,2-difluoroethyl)piperazine?
The canonical SMILES for 1-(2,2-difluoroethyl)piperazine is FC(F)CN1CCNCC1.
What is the InChIKey of 1-(2,2-difluoroethyl)piperazine?
The InChIKey is JIARBLBYLGYCBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12F2N2/c7-6(8)5-10-3-1-9-2-4-10/h6,9H,1-5H2.
What are the key properties of 1-(2,2-difluoroethyl)piperazine?
1-(2,2-difluoroethyl)piperazine has a molecular weight of 150.17 g/mol, XLogP of 0.16, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-difluoroethyl)piperazine is sourced from PubChem (CID 19622797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).