1-(2,2-difluoroethyl)-5-ethyl-2,2-dimethylpiperazine

C10H20F2N2 — CID 64842161

IUPAC1-(2,2-difluoroethyl)-5-ethyl-2,2-dimethylpiperazine
SMILESCCC1CN(CC(F)F)C(C)(C)CN1
InChIInChI=1S/C10H20F2N2/c1-4-8-5-14(6-9(11)12)10(2,3)7-13-8/h8-9,13H,4-7H2,1-3H3
InChIKeyYKSBUNSYSUDMBF-UHFFFAOYSA-N
MW206.28 g/mol
LogP1.71
Rot. Bonds3

About 1-(2,2-difluoroethyl)-5-ethyl-2,2-dimethylpiperazine

1-(2,2-difluoroethyl)-5-ethyl-2,2-dimethylpiperazine (PubChem CID 64842161) has the molecular formula C10H20F2N2 and a molecular weight of 206.28 g/mol. Its IUPAC name is 1-(2,2-difluoroethyl)-5-ethyl-2,2-dimethylpiperazine.

Molecular Properties

Compound Name1-(2,2-difluoroethyl)-5-ethyl-2,2-dimethylpiperazine
PubChem CID64842161
Molecular FormulaC10H20F2N2
Molecular Weight206.28 g/mol
Exact Mass206.16
IUPAC Name1-(2,2-difluoroethyl)-5-ethyl-2,2-dimethylpiperazine
SMILESCCC1CN(CC(F)F)C(C)(C)CN1
InChIInChI=1S/C10H20F2N2/c1-4-8-5-14(6-9(11)12)10(2,3)7-13-8/h8-9,13H,4-7H2,1-3H3
InChIKeyYKSBUNSYSUDMBF-UHFFFAOYSA-N
XLogP1.71
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.28
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-ethyl-2,2-dimethyl-1-(2-methylbutyl)piperazine
CID 64843133
5-butan-2-yl-1-(2,2-difluoroethyl)-2,2-dimethylpiperazine
CID 64849409
5-ethyl-1-(2-ethylhexyl)-2,2-dimethylpiperazine
CID 64843328
5-ethyl-2,2-dimethyl-1-pentylpiperazine
CID 64843523
2,2-dimethyl-1-(2-methylpropyl)-5-propylpiperazine
CID 64838610
1-[(2,5-difluorophenyl)methyl]-5-ethyl-2,2-dimethylpiperazine
CID 64841386
2,2-dimethyl-1-(2-methylpentyl)-5-(2-methylpropyl)piperazine
CID 64849914
1-[(3-chloro-2-fluorophenyl)methyl]-5-ethyl-2,2-dimethylpiperazine
CID 102862525
1-[(5-chlorothiophen-2-yl)methyl]-5-ethyl-2,2-dimethylpiperazine
CID 64841778
1-(2,2-difluoroethyl)-5-ethyl-2,2,5-trimethylpiperazine
CID 64849845
5-ethyl-2,2-dimethyl-1-[(2-methylphenyl)methyl]piperazine
CID 64843913
2,2-dimethyl-1-(2-methylbutyl)-5-propan-2-ylpiperazine
CID 64840227

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-difluoroethyl)-5-ethyl-2,2-dimethylpiperazine?
The IUPAC name of 1-(2,2-difluoroethyl)-5-ethyl-2,2-dimethylpiperazine (CID 64842161) is 1-(2,2-difluoroethyl)-5-ethyl-2,2-dimethylpiperazine.
What is the SMILES notation for 1-(2,2-difluoroethyl)-5-ethyl-2,2-dimethylpiperazine?
The canonical SMILES for 1-(2,2-difluoroethyl)-5-ethyl-2,2-dimethylpiperazine is CCC1CN(CC(F)F)C(C)(C)CN1.
What is the InChIKey of 1-(2,2-difluoroethyl)-5-ethyl-2,2-dimethylpiperazine?
The InChIKey is YKSBUNSYSUDMBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20F2N2/c1-4-8-5-14(6-9(11)12)10(2,3)7-13-8/h8-9,13H,4-7H2,1-3H3.
What are the key properties of 1-(2,2-difluoroethyl)-5-ethyl-2,2-dimethylpiperazine?
1-(2,2-difluoroethyl)-5-ethyl-2,2-dimethylpiperazine has a molecular weight of 206.28 g/mol, XLogP of 1.71, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-difluoroethyl)-5-ethyl-2,2-dimethylpiperazine is sourced from PubChem (CID 64842161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).