2-methyl-1-[1-(trifluoromethyl)cyclopropyl]piperazine

C9H15F3N2 — CID 106211889

IUPAC2-methyl-1-[1-(trifluoromethyl)cyclopropyl]piperazine
SMILESCC1CNCCN1C1(C(F)(F)F)CC1
InChIInChI=1S/C9H15F3N2/c1-7-6-13-4-5-14(7)8(2-3-8)9(10,11)12/h7,13H,2-6H2,1H3
InChIKeyZHWWCOJNSUUTQA-UHFFFAOYSA-N
MW208.23 g/mol
LogP1.38
Rot. Bonds1

About 2-methyl-1-[1-(trifluoromethyl)cyclopropyl]piperazine

2-methyl-1-[1-(trifluoromethyl)cyclopropyl]piperazine (PubChem CID 106211889) has the molecular formula C9H15F3N2 and a molecular weight of 208.23 g/mol. Its IUPAC name is 2-methyl-1-[1-(trifluoromethyl)cyclopropyl]piperazine.

Molecular Properties

Compound Name2-methyl-1-[1-(trifluoromethyl)cyclopropyl]piperazine
PubChem CID106211889
Molecular FormulaC9H15F3N2
Molecular Weight208.23 g/mol
Exact Mass208.12
IUPAC Name2-methyl-1-[1-(trifluoromethyl)cyclopropyl]piperazine
SMILESCC1CNCCN1C1(C(F)(F)F)CC1
InChIInChI=1S/C9H15F3N2/c1-7-6-13-4-5-14(7)8(2-3-8)9(10,11)12/h7,13H,2-6H2,1H3
InChIKeyZHWWCOJNSUUTQA-UHFFFAOYSA-N
XLogP1.38
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.23
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-[1-(trifluoromethyl)cyclopropyl]piperazine?
The IUPAC name of 2-methyl-1-[1-(trifluoromethyl)cyclopropyl]piperazine (CID 106211889) is 2-methyl-1-[1-(trifluoromethyl)cyclopropyl]piperazine.
What is the SMILES notation for 2-methyl-1-[1-(trifluoromethyl)cyclopropyl]piperazine?
The canonical SMILES for 2-methyl-1-[1-(trifluoromethyl)cyclopropyl]piperazine is CC1CNCCN1C1(C(F)(F)F)CC1.
What is the InChIKey of 2-methyl-1-[1-(trifluoromethyl)cyclopropyl]piperazine?
The InChIKey is ZHWWCOJNSUUTQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15F3N2/c1-7-6-13-4-5-14(7)8(2-3-8)9(10,11)12/h7,13H,2-6H2,1H3.
What are the key properties of 2-methyl-1-[1-(trifluoromethyl)cyclopropyl]piperazine?
2-methyl-1-[1-(trifluoromethyl)cyclopropyl]piperazine has a molecular weight of 208.23 g/mol, XLogP of 1.38, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-[1-(trifluoromethyl)cyclopropyl]piperazine is sourced from PubChem (CID 106211889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).