1-[4-(4-fluorophenyl)piperazin-1-yl]-3-(4-phenylphenyl)propan-2-amine

C25H28FN3 — CID 69186117

IUPAC1-[4-(4-fluorophenyl)piperazin-1-yl]-3-(4-phenylphenyl)propan-2-amine
SMILESNC(Cc1ccc(-c2ccccc2)cc1)CN1CCN(c2ccc(F)cc2)CC1
InChIInChI=1S/C25H28FN3/c26-23-10-12-25(13-11-23)29-16-14-28(15-17-29)19-24(27)18-20-6-8-22(9-7-20)21-4-2-1-3-5-21/h1-13,24H,14-19,27H2
InChIKeyXBNYVNKAWIVMQK-UHFFFAOYSA-N
MW389.52 g/mol
LogP4.18
Rot. Bonds6

About 1-[4-(4-fluorophenyl)piperazin-1-yl]-3-(4-phenylphenyl)propan-2-amine

1-[4-(4-fluorophenyl)piperazin-1-yl]-3-(4-phenylphenyl)propan-2-amine (PubChem CID 69186117) has the molecular formula C25H28FN3 and a molecular weight of 389.52 g/mol. Its IUPAC name is 1-[4-(4-fluorophenyl)piperazin-1-yl]-3-(4-phenylphenyl)propan-2-amine.

Molecular Properties

Compound Name1-[4-(4-fluorophenyl)piperazin-1-yl]-3-(4-phenylphenyl)propan-2-amine
PubChem CID69186117
Molecular FormulaC25H28FN3
Molecular Weight389.52 g/mol
Exact Mass389.23
IUPAC Name1-[4-(4-fluorophenyl)piperazin-1-yl]-3-(4-phenylphenyl)propan-2-amine
SMILESNC(Cc1ccc(-c2ccccc2)cc1)CN1CCN(c2ccc(F)cc2)CC1
InChIInChI=1S/C25H28FN3/c26-23-10-12-25(13-11-23)29-16-14-28(15-17-29)19-24(27)18-20-6-8-22(9-7-20)21-4-2-1-3-5-21/h1-13,24H,14-19,27H2
InChIKeyXBNYVNKAWIVMQK-UHFFFAOYSA-N
XLogP4.18
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.52
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[4-(4-fluorophenyl)piperazin-1-yl]-3-(4-phenylphenyl)propan-2-amine 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

1-[4-(4-fluorophenyl)piperazin-1-yl]-3-methoxypropan-2-amine
CID 81101377
1-(2,2-diphenylethyl)-4-(4-fluorophenyl)piperazine
CID 1376189
N-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]-2-(4-phenylphenyl)acetamide
CID 42266624
1-(4-phenylphenyl)aziridine
CID 152682568
(2S)-2-amino-1-[4-(4-fluorophenyl)piperazin-1-yl]-3-phenylpropan-1-one
CID 22691202
1-(2-bromo-3,3,3-trifluoropropyl)-4-(4-fluorophenyl)piperazine
CID 64758736
(2S)-1-[4-[2-[bis(4-fluorophenyl)methoxy]ethyl]piperidin-1-yl]-3-phenylpropan-2-amine
CID 11650367
2-amino-1-[4-(4-fluorophenyl)piperazin-1-yl]-3-phenylpropan-1-one;dihydrochloride
CID 119827481
1-benzyl-4-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]piperazine
CID 171911015
(2S)-3-methyl-1-(4-phenylpiperazin-1-yl)butan-2-amine
CID 22689467
(2R)-1-(4-methoxyphenyl)-3-[4-(2-methoxyphenyl)piperazin-1-yl]propan-2-amine
CID 70121693
1-[[5-(4-fluorophenyl)-3-pyridinyl]methyl]-4-phenylpiperazine
CID 21186124

Frequently Asked Questions

What is the IUPAC name of 1-[4-(4-fluorophenyl)piperazin-1-yl]-3-(4-phenylphenyl)propan-2-amine?
The IUPAC name of 1-[4-(4-fluorophenyl)piperazin-1-yl]-3-(4-phenylphenyl)propan-2-amine (CID 69186117) is 1-[4-(4-fluorophenyl)piperazin-1-yl]-3-(4-phenylphenyl)propan-2-amine.
What is the SMILES notation for 1-[4-(4-fluorophenyl)piperazin-1-yl]-3-(4-phenylphenyl)propan-2-amine?
The canonical SMILES for 1-[4-(4-fluorophenyl)piperazin-1-yl]-3-(4-phenylphenyl)propan-2-amine is NC(Cc1ccc(-c2ccccc2)cc1)CN1CCN(c2ccc(F)cc2)CC1.
What is the InChIKey of 1-[4-(4-fluorophenyl)piperazin-1-yl]-3-(4-phenylphenyl)propan-2-amine?
The InChIKey is XBNYVNKAWIVMQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H28FN3/c26-23-10-12-25(13-11-23)29-16-14-28(15-17-29)19-24(27)18-20-6-8-22(9-7-20)21-4-2-1-3-5-21/h1-13,24H,14-19,27H2.
What are the key properties of 1-[4-(4-fluorophenyl)piperazin-1-yl]-3-(4-phenylphenyl)propan-2-amine?
1-[4-(4-fluorophenyl)piperazin-1-yl]-3-(4-phenylphenyl)propan-2-amine has a molecular weight of 389.52 g/mol, XLogP of 4.18, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(4-fluorophenyl)piperazin-1-yl]-3-(4-phenylphenyl)propan-2-amine is sourced from PubChem (CID 69186117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).