1-phenyl-4-[(Z)-3,3,3-trifluoro-1-phenylprop-1-en-2-yl]piperazine

C19H19F3N2 — CID 139186104

IUPAC1-phenyl-4-[(Z)-3,3,3-trifluoro-1-phenylprop-1-en-2-yl]piperazine
SMILESFC(F)(F)/C(=C/c1ccccc1)N1CCN(c2ccccc2)CC1
InChIInChI=1S/C19H19F3N2/c20-19(21,22)18(15-16-7-3-1-4-8-16)24-13-11-23(12-14-24)17-9-5-2-6-10-17/h1-10,15H,11-14H2/b18-15-
InChIKeyUZBYOSNXLCAUQK-SDXDJHTJSA-N
MW332.37 g/mol
LogP4.41
Rot. Bonds3

About 1-phenyl-4-[(Z)-3,3,3-trifluoro-1-phenylprop-1-en-2-yl]piperazine

1-phenyl-4-[(Z)-3,3,3-trifluoro-1-phenylprop-1-en-2-yl]piperazine (PubChem CID 139186104) has the molecular formula C19H19F3N2 and a molecular weight of 332.37 g/mol. Its IUPAC name is 1-phenyl-4-[(Z)-3,3,3-trifluoro-1-phenylprop-1-en-2-yl]piperazine.

Molecular Properties

Compound Name1-phenyl-4-[(Z)-3,3,3-trifluoro-1-phenylprop-1-en-2-yl]piperazine
PubChem CID139186104
Molecular FormulaC19H19F3N2
Molecular Weight332.37 g/mol
Exact Mass332.15
IUPAC Name1-phenyl-4-[(Z)-3,3,3-trifluoro-1-phenylprop-1-en-2-yl]piperazine
SMILESFC(F)(F)/C(=C/c1ccccc1)N1CCN(c2ccccc2)CC1
InChIInChI=1S/C19H19F3N2/c20-19(21,22)18(15-16-7-3-1-4-8-16)24-13-11-23(12-14-24)17-9-5-2-6-10-17/h1-10,15H,11-14H2/b18-15-
InChIKeyUZBYOSNXLCAUQK-SDXDJHTJSA-N
XLogP4.41
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.37
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-phenyl-4-[(Z)-3,3,3-trifluoro-1-phenylprop-1-en-2-yl]piperazine?
The IUPAC name of 1-phenyl-4-[(Z)-3,3,3-trifluoro-1-phenylprop-1-en-2-yl]piperazine (CID 139186104) is 1-phenyl-4-[(Z)-3,3,3-trifluoro-1-phenylprop-1-en-2-yl]piperazine.
What is the SMILES notation for 1-phenyl-4-[(Z)-3,3,3-trifluoro-1-phenylprop-1-en-2-yl]piperazine?
The canonical SMILES for 1-phenyl-4-[(Z)-3,3,3-trifluoro-1-phenylprop-1-en-2-yl]piperazine is FC(F)(F)/C(=C/c1ccccc1)N1CCN(c2ccccc2)CC1.
What is the InChIKey of 1-phenyl-4-[(Z)-3,3,3-trifluoro-1-phenylprop-1-en-2-yl]piperazine?
The InChIKey is UZBYOSNXLCAUQK-SDXDJHTJSA-N. The full InChI is InChI=1S/C19H19F3N2/c20-19(21,22)18(15-16-7-3-1-4-8-16)24-13-11-23(12-14-24)17-9-5-2-6-10-17/h1-10,15H,11-14H2/b18-15-.
What are the key properties of 1-phenyl-4-[(Z)-3,3,3-trifluoro-1-phenylprop-1-en-2-yl]piperazine?
1-phenyl-4-[(Z)-3,3,3-trifluoro-1-phenylprop-1-en-2-yl]piperazine has a molecular weight of 332.37 g/mol, XLogP of 4.41, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-4-[(Z)-3,3,3-trifluoro-1-phenylprop-1-en-2-yl]piperazine is sourced from PubChem (CID 139186104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).