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

C11H22F2N2 — CID 64849845

IUPAC1-(2,2-difluoroethyl)-5-ethyl-2,2,5-trimethylpiperazine
SMILESCCC1(C)CN(CC(F)F)C(C)(C)CN1
InChIInChI=1S/C11H22F2N2/c1-5-11(4)8-15(6-9(12)13)10(2,3)7-14-11/h9,14H,5-8H2,1-4H3
InChIKeyVIEHFZCWBKEIRX-UHFFFAOYSA-N
MW220.31 g/mol
LogP2.10
Rot. Bonds3

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

1-(2,2-difluoroethyl)-5-ethyl-2,2,5-trimethylpiperazine (PubChem CID 64849845) has the molecular formula C11H22F2N2 and a molecular weight of 220.31 g/mol. Its IUPAC name is 1-(2,2-difluoroethyl)-5-ethyl-2,2,5-trimethylpiperazine.

Molecular Properties

Compound Name1-(2,2-difluoroethyl)-5-ethyl-2,2,5-trimethylpiperazine
PubChem CID64849845
Molecular FormulaC11H22F2N2
Molecular Weight220.31 g/mol
Exact Mass220.18
IUPAC Name1-(2,2-difluoroethyl)-5-ethyl-2,2,5-trimethylpiperazine
SMILESCCC1(C)CN(CC(F)F)C(C)(C)CN1
InChIInChI=1S/C11H22F2N2/c1-5-11(4)8-15(6-9(12)13)10(2,3)7-14-11/h9,14H,5-8H2,1-4H3
InChIKeyVIEHFZCWBKEIRX-UHFFFAOYSA-N
XLogP2.10
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.31
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-ethyl-1-(2-ethylbutyl)-2,2,5-trimethylpiperazine
CID 82925415
5-ethyl-2,2,5-trimethyl-1-(2,2,2-trifluoroethyl)piperazine
CID 64848330
5-ethyl-1,2,2,5-tetramethylpiperazine
CID 64848331
5-ethyl-1-[(2-fluorophenyl)methyl]-2,2,5-trimethylpiperazine
CID 64848517
1-(2,2-difluoroethyl)-2-ethyl-2,5,5-trimethylpiperazine
CID 64838559
5-ethyl-1-[(4-ethylphenyl)methyl]-2,2,5-trimethylpiperazine
CID 64850036
5-ethyl-2,2,5-trimethyl-1-(3-methylsulfonylpropyl)piperazine
CID 64849852
1-[(3-chloro-4-fluorophenyl)methyl]-5-ethyl-2,2,5-trimethylpiperazine
CID 103041811
1-[(2-chloro-5-fluorophenyl)methyl]-5-ethyl-2,2,5-trimethylpiperazine
CID 102620699
1-(2,2-difluoroethyl)-5-ethyl-2,2-dimethylpiperazine
CID 64842161
5,5-diethyl-1-(2-ethylbutyl)-2,2-dimethylpiperazine
CID 82925143
1-[(2,3-dichlorophenyl)methyl]-5-ethyl-2,2,5-trimethylpiperazine
CID 107310506

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-difluoroethyl)-5-ethyl-2,2,5-trimethylpiperazine?
The IUPAC name of 1-(2,2-difluoroethyl)-5-ethyl-2,2,5-trimethylpiperazine (CID 64849845) is 1-(2,2-difluoroethyl)-5-ethyl-2,2,5-trimethylpiperazine.
What is the SMILES notation for 1-(2,2-difluoroethyl)-5-ethyl-2,2,5-trimethylpiperazine?
The canonical SMILES for 1-(2,2-difluoroethyl)-5-ethyl-2,2,5-trimethylpiperazine is CCC1(C)CN(CC(F)F)C(C)(C)CN1.
What is the InChIKey of 1-(2,2-difluoroethyl)-5-ethyl-2,2,5-trimethylpiperazine?
The InChIKey is VIEHFZCWBKEIRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22F2N2/c1-5-11(4)8-15(6-9(12)13)10(2,3)7-14-11/h9,14H,5-8H2,1-4H3.
What are the key properties of 1-(2,2-difluoroethyl)-5-ethyl-2,2,5-trimethylpiperazine?
1-(2,2-difluoroethyl)-5-ethyl-2,2,5-trimethylpiperazine has a molecular weight of 220.31 g/mol, XLogP of 2.10, 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-2,2,5-trimethylpiperazine is sourced from PubChem (CID 64849845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).