3-ethyl-1-(2-fluorophenyl)piperazine

C12H17FN2 — CID 64924612

IUPAC3-ethyl-1-(2-fluorophenyl)piperazine
SMILESCCC1CN(c2ccccc2F)CCN1
InChIInChI=1S/C12H17FN2/c1-2-10-9-15(8-7-14-10)12-6-4-3-5-11(12)13/h3-6,10,14H,2,7-9H2,1H3
InChIKeyMAOHKYWVSBBDNI-UHFFFAOYSA-N
MW208.28 g/mol
LogP2.01
Rot. Bonds2

About 3-ethyl-1-(2-fluorophenyl)piperazine

3-ethyl-1-(2-fluorophenyl)piperazine (PubChem CID 64924612) has the molecular formula C12H17FN2 and a molecular weight of 208.28 g/mol. Its IUPAC name is 3-ethyl-1-(2-fluorophenyl)piperazine.

Molecular Properties

Compound Name3-ethyl-1-(2-fluorophenyl)piperazine
PubChem CID64924612
Molecular FormulaC12H17FN2
Molecular Weight208.28 g/mol
Exact Mass208.14
IUPAC Name3-ethyl-1-(2-fluorophenyl)piperazine
SMILESCCC1CN(c2ccccc2F)CCN1
InChIInChI=1S/C12H17FN2/c1-2-10-9-15(8-7-14-10)12-6-4-3-5-11(12)13/h3-6,10,14H,2,7-9H2,1H3
InChIKeyMAOHKYWVSBBDNI-UHFFFAOYSA-N
XLogP2.01
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.28
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-ethyl-1-(2-fluorophenyl)piperazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-ethyl-1-(2-fluorophenyl)-1,4-diazepane
CID 64942718
(3S)-3-ethyl-1-(2-methylsulfanylphenyl)piperazine
CID 58996610
1-(2,5-difluorophenyl)-3-ethylpiperazine
CID 64925171
1-[2-(difluoromethylsulfanyl)phenyl]-3-ethylpiperazine
CID 64925477
1-(2,6-difluorophenyl)-3-ethyl-1,4-diazepane
CID 64943922
3-ethyl-1-(3-fluoro-4-methylphenyl)piperazine
CID 64925990
3-ethyl-1-(2,3,4,5,6-pentafluorophenyl)piperazine
CID 115565133
1-(3-fluoro-2-methylphenyl)-3-(2-methylpropyl)piperazine
CID 64953125
1-(2,4-difluorophenyl)-3-propylpiperazine
CID 64925789
1-(2-bromo-4-chlorophenyl)-3-ethylpiperazine
CID 81271640
3-butan-2-yl-1-(2-fluorophenyl)-1,4-diazepane
CID 64942519
3-benzyl-1-(2,5-difluorophenyl)piperazine
CID 64925374

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-(2-fluorophenyl)piperazine?
The IUPAC name of 3-ethyl-1-(2-fluorophenyl)piperazine (CID 64924612) is 3-ethyl-1-(2-fluorophenyl)piperazine.
What is the SMILES notation for 3-ethyl-1-(2-fluorophenyl)piperazine?
The canonical SMILES for 3-ethyl-1-(2-fluorophenyl)piperazine is CCC1CN(c2ccccc2F)CCN1.
What is the InChIKey of 3-ethyl-1-(2-fluorophenyl)piperazine?
The InChIKey is MAOHKYWVSBBDNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17FN2/c1-2-10-9-15(8-7-14-10)12-6-4-3-5-11(12)13/h3-6,10,14H,2,7-9H2,1H3.
What are the key properties of 3-ethyl-1-(2-fluorophenyl)piperazine?
3-ethyl-1-(2-fluorophenyl)piperazine has a molecular weight of 208.28 g/mol, XLogP of 2.01, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-(2-fluorophenyl)piperazine is sourced from PubChem (CID 64924612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).