1-[[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]indazole

C19H19F3N4 — CID 23194171

IUPAC1-[[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]indazole
SMILESFC(F)(F)c1cccc(N2CCN(Cn3ncc4ccccc43)CC2)c1
InChIInChI=1S/C19H19F3N4/c20-19(21,22)16-5-3-6-17(12-16)25-10-8-24(9-11-25)14-26-18-7-2-1-4-15(18)13-23-26/h1-7,12-13H,8-11,14H2
InChIKeyOZLLGZFBZYYYNX-UHFFFAOYSA-N
MW360.38 g/mol
LogP3.83
Rot. Bonds3

About 1-[[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]indazole

1-[[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]indazole (PubChem CID 23194171) has the molecular formula C19H19F3N4 and a molecular weight of 360.38 g/mol. Its IUPAC name is 1-[[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]indazole.

Molecular Properties

Compound Name1-[[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]indazole
PubChem CID23194171
Molecular FormulaC19H19F3N4
Molecular Weight360.38 g/mol
Exact Mass360.16
IUPAC Name1-[[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]indazole
SMILESFC(F)(F)c1cccc(N2CCN(Cn3ncc4ccccc43)CC2)c1
InChIInChI=1S/C19H19F3N4/c20-19(21,22)16-5-3-6-17(12-16)25-10-8-24(9-11-25)14-26-18-7-2-1-4-15(18)13-23-26/h1-7,12-13H,8-11,14H2
InChIKeyOZLLGZFBZYYYNX-UHFFFAOYSA-N
XLogP3.83
TPSA24.30 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.38
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-[[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]indazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]indazole?
The IUPAC name of 1-[[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]indazole (CID 23194171) is 1-[[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]indazole.
What is the SMILES notation for 1-[[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]indazole?
The canonical SMILES for 1-[[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]indazole is FC(F)(F)c1cccc(N2CCN(Cn3ncc4ccccc43)CC2)c1.
What is the InChIKey of 1-[[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]indazole?
The InChIKey is OZLLGZFBZYYYNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19F3N4/c20-19(21,22)16-5-3-6-17(12-16)25-10-8-24(9-11-25)14-26-18-7-2-1-4-15(18)13-23-26/h1-7,12-13H,8-11,14H2.
What are the key properties of 1-[[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]indazole?
1-[[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]indazole has a molecular weight of 360.38 g/mol, XLogP of 3.83, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]indazole is sourced from PubChem (CID 23194171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).