1-[2-(2-ethyl-5-fluorophenyl)ethyl]piperazine

C14H21FN2 — CID 84798240

IUPAC1-[2-(2-ethyl-5-fluorophenyl)ethyl]piperazine
SMILESCCc1ccc(F)cc1CCN1CCNCC1
InChIInChI=1S/C14H21FN2/c1-2-12-3-4-14(15)11-13(12)5-8-17-9-6-16-7-10-17/h3-4,11,16H,2,5-10H2,1H3
InChIKeyGKEFDMPCZZBNRX-UHFFFAOYSA-N
MW236.33 g/mol
LogP1.84
Rot. Bonds4

About 1-[2-(2-ethyl-5-fluorophenyl)ethyl]piperazine

1-[2-(2-ethyl-5-fluorophenyl)ethyl]piperazine (PubChem CID 84798240) has the molecular formula C14H21FN2 and a molecular weight of 236.33 g/mol. Its IUPAC name is 1-[2-(2-ethyl-5-fluorophenyl)ethyl]piperazine.

Molecular Properties

Compound Name1-[2-(2-ethyl-5-fluorophenyl)ethyl]piperazine
PubChem CID84798240
Molecular FormulaC14H21FN2
Molecular Weight236.33 g/mol
Exact Mass236.17
IUPAC Name1-[2-(2-ethyl-5-fluorophenyl)ethyl]piperazine
SMILESCCc1ccc(F)cc1CCN1CCNCC1
InChIInChI=1S/C14H21FN2/c1-2-12-3-4-14(15)11-13(12)5-8-17-9-6-16-7-10-17/h3-4,11,16H,2,5-10H2,1H3
InChIKeyGKEFDMPCZZBNRX-UHFFFAOYSA-N
XLogP1.84
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.33
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-(2-chloro-5-fluorophenyl)ethyl]piperazine
CID 82622203
1-[2-(2-ethyl-5-fluoro-3-methoxyphenyl)ethyl]piperazine
CID 117420263
1-[2-(2-chloro-3,5-difluorophenyl)ethyl]piperazine
CID 117406196
2,4-difluoro-6-(2-piperazin-1-ylethyl)phenol
CID 115006371
1-[3-(5-fluoro-2-propoxyphenyl)propyl]piperazine
CID 83944159
1-[(5-fluoro-2-methylphenyl)methyl]piperazine
CID 22975139
1-[2-(3-ethyl-4-methylphenyl)ethyl]piperazine
CID 84696121
1-[(2-ethyl-5-methylphenyl)methyl]piperazine
CID 117311481
ethane;1-[(5-fluoro-2-methylphenyl)methyl]piperazine
CID 142195714
1-[2-(2-methoxy-5-methylphenyl)ethyl]piperazine
CID 82083196
1-[2-(3-ethyl-2,4-dimethoxyphenyl)ethyl]piperazine
CID 117446670
1-[(2,4-difluorophenyl)methyl]piperazine;hydrochloride
CID 90039977

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-ethyl-5-fluorophenyl)ethyl]piperazine?
The IUPAC name of 1-[2-(2-ethyl-5-fluorophenyl)ethyl]piperazine (CID 84798240) is 1-[2-(2-ethyl-5-fluorophenyl)ethyl]piperazine.
What is the SMILES notation for 1-[2-(2-ethyl-5-fluorophenyl)ethyl]piperazine?
The canonical SMILES for 1-[2-(2-ethyl-5-fluorophenyl)ethyl]piperazine is CCc1ccc(F)cc1CCN1CCNCC1.
What is the InChIKey of 1-[2-(2-ethyl-5-fluorophenyl)ethyl]piperazine?
The InChIKey is GKEFDMPCZZBNRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21FN2/c1-2-12-3-4-14(15)11-13(12)5-8-17-9-6-16-7-10-17/h3-4,11,16H,2,5-10H2,1H3.
What are the key properties of 1-[2-(2-ethyl-5-fluorophenyl)ethyl]piperazine?
1-[2-(2-ethyl-5-fluorophenyl)ethyl]piperazine has a molecular weight of 236.33 g/mol, XLogP of 1.84, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-ethyl-5-fluorophenyl)ethyl]piperazine is sourced from PubChem (CID 84798240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).