1-[[4-(fluoromethyl)phenyl]methyl]-4-phenylpiperazine

C18H21FN2 — CID 11859050

IUPAC1-[[4-(fluoromethyl)phenyl]methyl]-4-phenylpiperazine
SMILESFCc1ccc(CN2CCN(c3ccccc3)CC2)cc1
InChIInChI=1S/C18H21FN2/c19-14-16-6-8-17(9-7-16)15-20-10-12-21(13-11-20)18-4-2-1-3-5-18/h1-9H,10-15H2
InChIKeyPPHZDLRSVPKYHD-UHFFFAOYSA-N
MW284.38 g/mol
LogP3.48
Rot. Bonds4

About 1-[[4-(fluoromethyl)phenyl]methyl]-4-phenylpiperazine

1-[[4-(fluoromethyl)phenyl]methyl]-4-phenylpiperazine (PubChem CID 11859050) has the molecular formula C18H21FN2 and a molecular weight of 284.38 g/mol. Its IUPAC name is 1-[[4-(fluoromethyl)phenyl]methyl]-4-phenylpiperazine.

Molecular Properties

Compound Name1-[[4-(fluoromethyl)phenyl]methyl]-4-phenylpiperazine
PubChem CID11859050
Molecular FormulaC18H21FN2
Molecular Weight284.38 g/mol
Exact Mass284.17
IUPAC Name1-[[4-(fluoromethyl)phenyl]methyl]-4-phenylpiperazine
SMILESFCc1ccc(CN2CCN(c3ccccc3)CC2)cc1
InChIInChI=1S/C18H21FN2/c19-14-16-6-8-17(9-7-16)15-20-10-12-21(13-11-20)18-4-2-1-3-5-18/h1-9H,10-15H2
InChIKeyPPHZDLRSVPKYHD-UHFFFAOYSA-N
XLogP3.48
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.38
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(4-ethoxyphenyl)methyl]-4-phenylpiperazine
CID 763918
1-[[4-(2-methylpropyl)phenyl]methyl]-4-phenylpiperazine
CID 174263891
1-benzyl-4-[4-(bromomethyl)phenyl]piperazine
CID 107079129
1-[(4-methylsulfonylphenyl)methyl]-4-phenylpiperazine
CID 141118596
1-benzyl-4-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]piperazine
CID 171911015
4-[(4-phenylpiperazin-1-yl)methyl]benzene-1,2-diol
CID 118737764
1,4,7,10-tetrabenzyl-1,4,7,10-tetrazacyclododecane
CID 160853215
9-ethyl-3-[(4-phenylpiperazin-1-yl)methyl]carbazole
CID 2058524
1-phenyl-4-[(1-phenylpyrrol-3-yl)methyl]piperazine
CID 10567507
N-methyl-4-[(4-phenylpiperazin-1-yl)methyl]benzamide
CID 1364206
2-[4-[(4-phenylpiperazin-1-yl)methyl]phenyl]sulfanyl-1,3-dihydroisoindole
CID 89232133
4-(4-benzylpiperazin-1-yl)-N-ethylaniline
CID 19911465

Frequently Asked Questions

What is the IUPAC name of 1-[[4-(fluoromethyl)phenyl]methyl]-4-phenylpiperazine?
The IUPAC name of 1-[[4-(fluoromethyl)phenyl]methyl]-4-phenylpiperazine (CID 11859050) is 1-[[4-(fluoromethyl)phenyl]methyl]-4-phenylpiperazine.
What is the SMILES notation for 1-[[4-(fluoromethyl)phenyl]methyl]-4-phenylpiperazine?
The canonical SMILES for 1-[[4-(fluoromethyl)phenyl]methyl]-4-phenylpiperazine is FCc1ccc(CN2CCN(c3ccccc3)CC2)cc1.
What is the InChIKey of 1-[[4-(fluoromethyl)phenyl]methyl]-4-phenylpiperazine?
The InChIKey is PPHZDLRSVPKYHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21FN2/c19-14-16-6-8-17(9-7-16)15-20-10-12-21(13-11-20)18-4-2-1-3-5-18/h1-9H,10-15H2.
What are the key properties of 1-[[4-(fluoromethyl)phenyl]methyl]-4-phenylpiperazine?
1-[[4-(fluoromethyl)phenyl]methyl]-4-phenylpiperazine has a molecular weight of 284.38 g/mol, XLogP of 3.48, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[4-(fluoromethyl)phenyl]methyl]-4-phenylpiperazine is sourced from PubChem (CID 11859050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).