1-(4-fluorophenyl)-4-[2-(4-methoxyphenyl)ethyl]piperazine

C19H23FN2O — CID 15527072

IUPAC1-(4-fluorophenyl)-4-[2-(4-methoxyphenyl)ethyl]piperazine
SMILESCOc1ccc(CCN2CCN(c3ccc(F)cc3)CC2)cc1
InChIInChI=1S/C19H23FN2O/c1-23-19-8-2-16(3-9-19)10-11-21-12-14-22(15-13-21)18-6-4-17(20)5-7-18/h2-9H,10-15H2,1H3
InChIKeyCCPYRYGGRYUCLG-UHFFFAOYSA-N
MW314.40 g/mol
LogP3.20
Rot. Bonds5

About 1-(4-fluorophenyl)-4-[2-(4-methoxyphenyl)ethyl]piperazine

1-(4-fluorophenyl)-4-[2-(4-methoxyphenyl)ethyl]piperazine (PubChem CID 15527072) has the molecular formula C19H23FN2O and a molecular weight of 314.40 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-4-[2-(4-methoxyphenyl)ethyl]piperazine.

Molecular Properties

Compound Name1-(4-fluorophenyl)-4-[2-(4-methoxyphenyl)ethyl]piperazine
PubChem CID15527072
Molecular FormulaC19H23FN2O
Molecular Weight314.40 g/mol
Exact Mass314.18
IUPAC Name1-(4-fluorophenyl)-4-[2-(4-methoxyphenyl)ethyl]piperazine
SMILESCOc1ccc(CCN2CCN(c3ccc(F)cc3)CC2)cc1
InChIInChI=1S/C19H23FN2O/c1-23-19-8-2-16(3-9-19)10-11-21-12-14-22(15-13-21)18-6-4-17(20)5-7-18/h2-9H,10-15H2,1H3
InChIKeyCCPYRYGGRYUCLG-UHFFFAOYSA-N
XLogP3.20
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.40
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-[4-(4-fluorophenyl)piperazin-1-yl]-N-[2-(4-methoxyphenyl)ethyl]propanamide
CID 109025749
1-[2-(4-fluorophenyl)ethyl]-3-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]urea
CID 39977337
N-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]-3-(4-methoxyphenyl)propanamide
CID 42224826
2-(4-fluorophenyl)-N-[2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl]acetamide
CID 42266374
1-(4-fluorophenyl)-4-[4-(4-methoxyphenyl)butan-2-yl]piperazine
CID 2846364
3-[4-(4-fluorophenyl)piperazin-1-yl]-4-[2-(4-methoxyphenyl)ethylamino]cyclobut-3-ene-1,2-dione
CID 53370738
4-(4-fluorophenoxy)-2-[4-[2-(4-methoxyphenyl)ethyl]piperazin-1-yl]pyrimidine
CID 56556990
1-(4-methoxyphenyl)-4-propylpiperazine
CID 12854846
N-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]-2-(4-methoxyphenoxy)acetamide
CID 42266721
1-(4-methoxyphenyl)-4-(2-piperidin-1-ylethyl)piperazine
CID 1439447
5-(4-fluorophenyl)-1-[4-(4-methoxyphenyl)piperazin-1-yl]pentan-1-one
CID 110297793
1-[3-[4-(4-fluorophenyl)-1,2,4-triazol-3-yl]propyl]-4-(4-methoxyphenyl)piperazine
CID 15575691

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-4-[2-(4-methoxyphenyl)ethyl]piperazine?
The IUPAC name of 1-(4-fluorophenyl)-4-[2-(4-methoxyphenyl)ethyl]piperazine (CID 15527072) is 1-(4-fluorophenyl)-4-[2-(4-methoxyphenyl)ethyl]piperazine.
What is the SMILES notation for 1-(4-fluorophenyl)-4-[2-(4-methoxyphenyl)ethyl]piperazine?
The canonical SMILES for 1-(4-fluorophenyl)-4-[2-(4-methoxyphenyl)ethyl]piperazine is COc1ccc(CCN2CCN(c3ccc(F)cc3)CC2)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-4-[2-(4-methoxyphenyl)ethyl]piperazine?
The InChIKey is CCPYRYGGRYUCLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23FN2O/c1-23-19-8-2-16(3-9-19)10-11-21-12-14-22(15-13-21)18-6-4-17(20)5-7-18/h2-9H,10-15H2,1H3.
What are the key properties of 1-(4-fluorophenyl)-4-[2-(4-methoxyphenyl)ethyl]piperazine?
1-(4-fluorophenyl)-4-[2-(4-methoxyphenyl)ethyl]piperazine has a molecular weight of 314.40 g/mol, XLogP of 3.20, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-4-[2-(4-methoxyphenyl)ethyl]piperazine is sourced from PubChem (CID 15527072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).