3-cyclopropyl-1-(2-fluoroethyl)-3-methylpiperazine

C10H19FN2 — CID 80695964

IUPAC3-cyclopropyl-1-(2-fluoroethyl)-3-methylpiperazine
SMILESCC1(C2CC2)CN(CCF)CCN1
InChIInChI=1S/C10H19FN2/c1-10(9-2-3-9)8-13(6-4-11)7-5-12-10/h9,12H,2-8H2,1H3
InChIKeyWSODOUBZYSIJGD-UHFFFAOYSA-N
MW186.27 g/mol
LogP1.03
Rot. Bonds3

About 3-cyclopropyl-1-(2-fluoroethyl)-3-methylpiperazine

3-cyclopropyl-1-(2-fluoroethyl)-3-methylpiperazine (PubChem CID 80695964) has the molecular formula C10H19FN2 and a molecular weight of 186.27 g/mol. Its IUPAC name is 3-cyclopropyl-1-(2-fluoroethyl)-3-methylpiperazine.

Molecular Properties

Compound Name3-cyclopropyl-1-(2-fluoroethyl)-3-methylpiperazine
PubChem CID80695964
Molecular FormulaC10H19FN2
Molecular Weight186.27 g/mol
Exact Mass186.15
IUPAC Name3-cyclopropyl-1-(2-fluoroethyl)-3-methylpiperazine
SMILESCC1(C2CC2)CN(CCF)CCN1
InChIInChI=1S/C10H19FN2/c1-10(9-2-3-9)8-13(6-4-11)7-5-12-10/h9,12H,2-8H2,1H3
InChIKeyWSODOUBZYSIJGD-UHFFFAOYSA-N
XLogP1.03
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.27
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-Cyclopropyl-1-methylpiperazine
CID 54518089
3-Cyclopropyl-1-methylpiperazine
CID 58803041
3-Isobutyl-1-methylpiperazine
CID 64833232
N,N,3-trimethylpiperidin-3-amine
CID 117000006
N-[2-(4-fluoropiperidin-1-yl)ethyl]-2-methylpropan-2-amine
CID 21030134
3-(Fluoromethyl)-1-propan-2-ylpiperidin-3-amine
CID 57886905
1-tert-butyl-N-(2-fluoropropyl)piperidin-3-amine
CID 58311605
(S)-2-isobutyl-1-(2,2,2-trifluoroethyl)piperazine
CID 58612005
2-(2-Methylpropyl)-1-(2,2,2-trifluoroethyl)piperazine
CID 64844275
N-[[1-(2-fluoroethyl)piperidin-4-yl]methyl]-2-methylpropan-2-amine
CID 80695059
1-Ethyl-3-(fluoromethyl)piperidin-3-amine
CID 115012596
(3S,5R)-1-tert-butyl-5-(trifluoromethyl)piperidin-3-amine
CID 117915958

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-1-(2-fluoroethyl)-3-methylpiperazine?
The IUPAC name of 3-cyclopropyl-1-(2-fluoroethyl)-3-methylpiperazine (CID 80695964) is 3-cyclopropyl-1-(2-fluoroethyl)-3-methylpiperazine.
What is the SMILES notation for 3-cyclopropyl-1-(2-fluoroethyl)-3-methylpiperazine?
The canonical SMILES for 3-cyclopropyl-1-(2-fluoroethyl)-3-methylpiperazine is CC1(C2CC2)CN(CCF)CCN1.
What is the InChIKey of 3-cyclopropyl-1-(2-fluoroethyl)-3-methylpiperazine?
The InChIKey is WSODOUBZYSIJGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19FN2/c1-10(9-2-3-9)8-13(6-4-11)7-5-12-10/h9,12H,2-8H2,1H3.
What are the key properties of 3-cyclopropyl-1-(2-fluoroethyl)-3-methylpiperazine?
3-cyclopropyl-1-(2-fluoroethyl)-3-methylpiperazine has a molecular weight of 186.27 g/mol, XLogP of 1.03, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-1-(2-fluoroethyl)-3-methylpiperazine is sourced from PubChem (CID 80695964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).