2,5-dimethyl-1-[1-(trifluoromethyl)cyclopropyl]piperazine

C10H17F3N2 — CID 106211954

IUPAC2,5-dimethyl-1-[1-(trifluoromethyl)cyclopropyl]piperazine
SMILESCC1CN(C2(C(F)(F)F)CC2)C(C)CN1
InChIInChI=1S/C10H17F3N2/c1-7-6-15(8(2)5-14-7)9(3-4-9)10(11,12)13/h7-8,14H,3-6H2,1-2H3
InChIKeyROOSFYDRWIAQRO-UHFFFAOYSA-N
MW222.25 g/mol
LogP1.76
Rot. Bonds1

About 2,5-dimethyl-1-[1-(trifluoromethyl)cyclopropyl]piperazine

2,5-dimethyl-1-[1-(trifluoromethyl)cyclopropyl]piperazine (PubChem CID 106211954) has the molecular formula C10H17F3N2 and a molecular weight of 222.25 g/mol. Its IUPAC name is 2,5-dimethyl-1-[1-(trifluoromethyl)cyclopropyl]piperazine.

Molecular Properties

Compound Name2,5-dimethyl-1-[1-(trifluoromethyl)cyclopropyl]piperazine
PubChem CID106211954
Molecular FormulaC10H17F3N2
Molecular Weight222.25 g/mol
Exact Mass222.13
IUPAC Name2,5-dimethyl-1-[1-(trifluoromethyl)cyclopropyl]piperazine
SMILESCC1CN(C2(C(F)(F)F)CC2)C(C)CN1
InChIInChI=1S/C10H17F3N2/c1-7-6-15(8(2)5-14-7)9(3-4-9)10(11,12)13/h7-8,14H,3-6H2,1-2H3
InChIKeyROOSFYDRWIAQRO-UHFFFAOYSA-N
XLogP1.76
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.25
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-tert-butyl-2-methyl-1-[1-(trifluoromethyl)cyclopropyl]piperazine
CID 114158826
5-ethyl-2-methyl-1-[1-(trifluoromethyl)cyclopropyl]piperazine
CID 106211860
5-butan-2-yl-2-methyl-1-[1-(trifluoromethyl)cyclopropyl]piperazine
CID 114158815
5,5-diethyl-2-methyl-1-[1-(trifluoromethyl)cyclopropyl]piperazine
CID 114158814
5-tert-butyl-2-propan-2-yl-1-[1-(trifluoromethyl)cyclopropyl]piperazine
CID 106211932
1-(2,5-dimethylpiperazin-1-yl)-3,3,3-trifluoro-2-(trifluoromethyl)propan-1-one
CID 103309302
2,5-dimethyl-1-[4-(trifluoromethyl)phenyl]piperazine
CID 11565121
(2S)-2,5-dimethyl-1-[4-(trifluoromethyl)phenyl]piperazine
CID 70804072
2-(2,5-dimethylpiperazin-1-yl)ethanamine
CID 19767343
1-cyclopropyl-2,5-dimethylpiperazine
CID 64954280
2,5-dimethyl-1-(2,3,3-trimethylbutyl)piperazine
CID 83147550
(5S)-2,5-dimethyl-1-prop-2-enylpiperazine
CID 91251130

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-1-[1-(trifluoromethyl)cyclopropyl]piperazine?
The IUPAC name of 2,5-dimethyl-1-[1-(trifluoromethyl)cyclopropyl]piperazine (CID 106211954) is 2,5-dimethyl-1-[1-(trifluoromethyl)cyclopropyl]piperazine.
What is the SMILES notation for 2,5-dimethyl-1-[1-(trifluoromethyl)cyclopropyl]piperazine?
The canonical SMILES for 2,5-dimethyl-1-[1-(trifluoromethyl)cyclopropyl]piperazine is CC1CN(C2(C(F)(F)F)CC2)C(C)CN1.
What is the InChIKey of 2,5-dimethyl-1-[1-(trifluoromethyl)cyclopropyl]piperazine?
The InChIKey is ROOSFYDRWIAQRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F3N2/c1-7-6-15(8(2)5-14-7)9(3-4-9)10(11,12)13/h7-8,14H,3-6H2,1-2H3.
What are the key properties of 2,5-dimethyl-1-[1-(trifluoromethyl)cyclopropyl]piperazine?
2,5-dimethyl-1-[1-(trifluoromethyl)cyclopropyl]piperazine has a molecular weight of 222.25 g/mol, XLogP of 1.76, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-1-[1-(trifluoromethyl)cyclopropyl]piperazine is sourced from PubChem (CID 106211954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).